Crystallography Open Database

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2312634 CIFC Cl2 SP 63/m5.961975; 5.961975; 6.304428
90; 90; 120		194.069Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312635 CIFC Cl2 SP 63/m5.964911; 5.964911; 6.317775
90; 90; 120		194.672Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312636 CIFC Cl2 SP 63/m5.967823; 5.967823; 6.331802
90; 90; 120		195.294Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312637 CIFC Cl2 SP 63/m5.970876; 5.970876; 6.346393
90; 90; 120		195.945Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312638 CIFC Cl2 SP 63/m5.973921; 5.973921; 6.361643
90; 90; 120		196.616Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312639 CIFC Cl2 SP 63/m5.977085; 5.977085; 6.377402
90; 90; 120		197.312Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312640 CIFC Cl2 SP 63/m5.98029; 5.98029; 6.393824
90; 90; 120		198.032Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312641 CIFC Cl2 SP 63/m5.983549; 5.983549; 6.410593
90; 90; 120		198.768Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312642 CIFC Cl2 SP 63/m5.986904; 5.986904; 6.42811
90; 90; 120		199.535Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312643 CIFC Cl2 SP 63/m5.990647; 5.990647; 6.446911
90; 90; 120		200.369Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312644 CIFC Cl2 SP 63/m5.994491; 5.994491; 6.46654
90; 90; 120		201.237Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312645 CIFC Cl2 SP 63/m5.998426; 5.998426; 6.487189
90; 90; 120		202.144Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312646 CIFC Cl2 SP 63/m6.0025; 6.0025; 6.50883
90; 90; 120		203.094Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312647 CIFC Cl2 SP 63/m6.006775; 6.006775; 6.53172
90; 90; 120		204.099Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312648 CIFC Cl2 SP 63/m6.011293; 6.011293; 6.55562
90; 90; 120		205.154Tambornino, Frank; Ringelband, Sven; Parker, Stewart F.; Howard, Christopher M.; Fortes, Dominic
A comprehensive characterization of thiophosgene in the solid state.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
2312665 CIF
HKL
Paper		C10 H2 K2 N10 O4C 1 2/c 134.434; 3.41097; 28.253
90; 126.49; 90		2667.9Gaydamaka, A. A.; Rashchenko, S. V.
Crystal structure of the incommensurate modulated high-pressure phase of the potassium guaninate monohydrate.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80
5000003 CIFC4 H10 N2 O4P 21 21 215.593; 9.827; 11.808
90; 90; 90		649Verbist, J. J.; Lehmann, M. S.; Koetzle, T. F.; Hamilton, W. C.
Precision neutron diffraction structure determination of protein and nucleic acid components. VI. The crystal and molecular structure of the amino acid L-asparagine monohydrate
Acta Crystallographica Section B, 1972, 28, 3006-3013
5000004 CIFC4 H7 N O4P 1 21 17.617; 6.982; 5.142
90; 99.84; 90		269.44Derissen, J. L.; Endeman, H. J.; Peerdeman, A. F.
The crystal and molecular structure of L-aspartic acid
Acta Crystallographica Section B, 1968, 24, 1349-1354
5000006 CIFC5 H10 N2 O3P 21 21 2116.02; 7.762; 5.119
90; 90; 90		636.53Koetzle, T. F.; Frey, M. N.; Lehmann, M. S.; Hamilton, W. C.
Precision neutron diffraction structure determination of protein and nucleic acid components. XIII. Molecular and crystal structure of the amino acid L-glutamine
Acta Crystallographica Section B, 1973, 29, 2571-2575
5000007 CIF
Paper		C5 H10 Cl N O4P 21 21 215.151; 11.789; 13.347
90; 90; 90		810.5Sequeira, A.; Rajagopal, H.; Chidambaram, R.
A neutron diffraction study of the structure of L-glutamic acid.HCl
Acta Crystallographica Section B, 1972, 28, 2514-2519
5000009 CIFC6 H9 N3 O2P 1 21 15.172; 7.384; 9.474
90; 97.162; 90		358.99Madden, J. J.; McGandy, E. L.; Seeman, N. C.; Harding, M. M.; Hoy, A.
The crystal structure of the monoclinic form of L-histidine
Acta Crystallographica Section B, 1972, 28, 2382-2389
5000011 CIFC6 H19 Cl N2 O4P 1 21 17.492; 13.32; 5.879
90; 97.79; 90		581.27Koetzle, T. F.; Lehmann, M. S.; Verbist, J. J.; Hamilton, W. C.
Precision neutron diffraction structure determination of protein and nucleic acid components. VII. The crystal and molecular structure of the amino acid L-lysine monohydrochloride dihydrate
Acta Crystallographica Section B, 1972, 28, 3207-3214
5000013 CIFC9 H12 Cl N O2P 21 21 2127.763; 7.059; 5.38
90; 90; 90		1054.37Al-Karaghouli, A. R.; Koetzle, T. F.
Neutron diffraction study of L-phenylalanine hydrochloride
Acta Crystallographica Section B, 1975, 31, 2461-2465
5000015 CIFC3 H7 N O3P 21 21 218.599; 9.348; 5.618
90; 90; 90		451.59Kistenmacher, T. J.; Rand, G. A.; Marsh, R. E.
Refinements of the crystal structures of DL-serine and anhydrous L-serine
Acta Crystallographica Section B, 1974, 30, 2573-2578
5000018 CIFC10 H13 N5 O4P 1 21 14.825; 10.282; 11.823
90; 99.3; 90		578.84Lai, T. F.; Marsh, R. E.
The crystal structure of adenosine
Acta Crystallographica Section B, 1972, 28, 1982-1989
5000020 CIFC10 H17 N5 O7P 1 21 117.518; 11.502; 6.658
90; 98.17; 90		1327.92Thewalt, U.; Bugg, C. E.; Marsh, R. E.
The crystal structure of guanosine dihydrate and inosine dihydrate
Acta Crystallographica Section B, 1970, 26, 1089-1101
5000021 CIFC10 H14 N2 O5P 21 21 214.86; 13.91; 16.32
90; 90; 90		1103.27Young, D. W.; Tollin, P.; Wilson, H. R.
The crystal and molecular structure of thymidine
Acta Crystallographica Section B, 1969, 25, 1423-1432
5000022 CIFC12 H18 N2 O10P 1 21 111.159; 14.461; 4.821
90; 101.15; 90		763.28Morikawa, K.; Torii, K.; Iitaka, Y.; Tsuboi, M.
Uridine-5-oxyacetic acid methyl ester monohydrate
Acta Crystallographica Section B, 1975, 31, 1004-1007
5000023 CIFC12 H8 Cl2P 1 21/n 115.78; 13.74; 9.682
90; 96.23; 90		2086.83Brock, C. P.; Kuo, M. S.; Levy, H. A.
4,4'-Dichlorobiphenyl: crystal packing in para-substituted biphenyls
Acta Crystallographica Section B, 1978, 34, 981-985
5000024 CIFC12 Cl10P b c n13.372; 10.497; 11.992
90; 90; 90		1683.27Pedersen, B.
Decachlorobiphenyl, C~12~Cl~10~: the crystal and molecular structure
Acta Crystallographica Section B, 1975, 31, 2931-2933
5000031 CIFC18 H25 O2.499P 21 21 212.055; 19.28; 6.63
90; 90; 90		1540.95Busetta, B.; Hospital, M.
Structure cristalline et moleculaire de l'oestradiol hemihydrate
Acta Crystallographica Section B, 1972, 28, 560-567
5000032 CIFC18 H22 O2P 21 21 2110.043; 18.424; 7.787
90; 90; 90		1440.85Busetta, B.; Courseille, C.; Hospital, M.
Structure cristallines et moleculaires de trois formes polymorphes de l'oestrone
Acta Crystallographica Section B, 1973, 29, 298-313
5000038 CIFO2 ZrF m -3 m5.1291; 5.1291; 5.1291
90; 90; 90		134.9Martin, U; Boysen, H; Frey, F
Neutron powder investigation of tetragonal and cubic stabilized zirconia, TZP and CSZ, at temperatures up to 1400 K
Acta Crystallographica Section B, 1993, 49, 403-413
5000063 CIFC6 H8 O7P 1 21/a 112.817; 5.628; 11.465
90; 111.22; 90		770.94Glusker, J. P.; Minkin, J. A.; Patterson, A. L.
X-ray crystal analysis of the substrates of aconitase. IX. A refinement of the structure of anhydrous citric acid
Acta Crystallographica Section B, 1969, 25, 1066-1072
5000065 CIFC6 H12 O6P 21 21 218.088; 9.204; 10.034
90; 90; 90		746.95Kanters, J. A.; Roelofsen, G.; Alblas, B. P.; Meinders, I.
The crystal and molecular structure of β-d-fructose, with emphasis on anomeric effect and hydrogen-bond interactions
Acta Crystallographica Section B, 1977, 33, 665-672
5000078 CIFC4 H3 F N2 O2P -19.22; 12.66; 12.67
89.7; 43.9; 98.6		1000.08Fallon, III, L.
The crystal and molecular structure of 5-fluorouracil
Acta Crystallographica Section B, 1973, 29, 2549-2556
5000084 CIFC22 H29 F O4P 21 21 2111.319; 22.803; 7.381
90; 90; 90		1905.09Dupont, L.; Dideberg, O.; Campsteyn, H.
Structure cristalline de la l7-désoxyméthasone, C~22~H~29~O~4~F
Acta Crystallographica Section B, 1974, 30, 514-516
5000102 CIFC17 H19 N O3P 1 21/n 18.743; 13.364; 13.147
90; 108.66; 90		1455.37Grynpas, M.; Lindley, P. F.
The crystal and molecular structure of 1-piperoylpiperidine
Acta Crystallographica Section B, 1975, 31, 2663-2667
5000111 CIFC27 H46 OP 114.172; 34.209; 10.481
94.64; 90.67; 96.32		5032.77Shieh, H.-S.; Hoard, L. G.; Nordman, C. E.
The structure of cholesterol
Acta Crystallographica Section B, 1981, 37, 1538-1543
5000131 CIFC5 H6 N4 O SC 1 2/c 115.294; 7.732; 12.379
90; 101.64; 90		1433.75Sletten, E.; Sletten, J.; Jensen, L. H.
The crystal and molecular structure of 6-mercaptopurine monohydrate
Acta Crystallographica Section B, 1969, 25, 1330-1338
5000140 CIFC6 H2 Cl N3 O6P 1 21/a 111.02; 6.795; 14.964
90; 124.15; 90		927.31Willis, J. S.; Stewart, J. M.; Ammon, H. L.; Preston, H. S.; Gluyas, R. E.; Harris, P. M.
The crystal structure of picryl chloride
Acta Crystallographica Section B, 1971, 27, 786-793
5000142 CIFC6 H4 N2 O5P 21 21 216.106; 23.24; 5.168
90; 90; 90		733.36Kagawa, T.; Kawai, R.; Kashino, S.; Haisa, M.
The crystal and molecular structure of 2,4-dinitrophenol
Acta Crystallographica Section B, 1976, 32, 3171-3175
5000144 CIFC H4 N4 O2F d d 217.6152; 24.8502; 3.588
90; 90; 90		1570.62Choi, C. S.
Refinement of 2-nitroguanidine by neutron powder diffraction
Acta Crystallographica Section B, 1981, 37, 1955-1957
5000148 CIFC3 H6 N6 O6P b c a13.182; 11.574; 10.709
90; 90; 90		1633.86Choi, C. S.; Prince, E.
The crystal structure of cyclotrimethylenetrinitramine
Acta Crystallographica Section B, 1972, 28, 2857-2862
5000150 CIFC6 H3 N3 O6P b c a9.78; 26.94; 12.82
90; 90; 90		3377.73Choi, C. S.; Abel, J. E.
The crystal structure of 1,3,5-trinitrobenzene by neutron diffraction
Acta Crystallographica Section B, 1972, 28, 193-201
5000151 CIFC6 H4.339 N3 O8.669P -3 c 112.6077; 12.6077; 10.1147
90; 90; 120		1392.37Pierce-Butler, M.
Structures of 2,4,6-trinitro-1.3-benzenediol 2/3-hydrate and 2,4,6-trinitro-1,3,5-benzenetriol 2/3-hydrate
Acta Crystallographica Section B, 1982, 38, 3097-3100
5000152 CIFC H5 N3 O4P 1 21/c 19.543; 8.201; 7.498
90; 124.25; 90		485.05Worsham, Jr, J. E.; Busing, W. R.
The crystal structure of uronium nitrate (urea nitrate) by neutron diffraction
Acta Crystallographica Section B, 1969, 25, 572-578
5000153 CIFC H6 N4 SP 1 21/c 14.74; 15.53; 7.19
90; 122.4; 90		446.88Braibanti, A.; Tiripicchio, A.; Camellini, M. T.
Crystal and molecular structure of thiocarbohydrazide
Acta Crystallographica Section B, 1969, 25, 2286-2290
5000154 CIFC5 H8 N4 O12P c n b13.29; 13.49; 6.83
90; 90; 90		1224.5Cady, H. H.; Larson, A. C.
Pentaerythritol tetranitrate II: its crystal structure and transformation to PETN I; an algorithm for refinement of crystal structures with poor data
Acta Crystallographica Section B, 1975, 31, 1864-1869
5000158 CIFC12 H22 O4P 1 21/c 113.105; 4.921; 10.183
90; 97.4; 90		651.23Vanier, M.; Brisse, F.
Nouvel affinement de la structure de l'acide dodécanedioïque
Acta Crystallographica Section B, 1982, 38, 643-645
5000165 CIFC15 H13 N OC 1 c 116.77; 4.83; 15.85
90; 115.4; 90		1159.73Haisa, M.; Kashino, S.; Ueno, T.; Shinozaki, N.; Matsuzaki, Y.
The structures of N-aromatic amides: p-acetanisidide, N-2-naphthylacetamide and N-2-fluorenylacetamide
Acta Crystallographica Section B, 1980, 36, 2306-2311
5000166 CIFC8 H8 OP 1 21/n 110.256; 8.678; 8.558
90; 121; 90		652.88Tanimoto, Y.; Kobayashi, H.; Nagakura, S.; Saito, Y.
The crystal structure of acetophenone at 154 K
Acta Crystallographica Section B, 1973, 29, 1822-1826
5000168 CIFC14 H10P 1 21/a 18.5526; 6.0158; 11.172
90; 124.596; 90		473.168Brock, C. P.; Dunitz, J. D.
Temperature dependence of thermal motion in crystalline anthracene
Acta Crystallographica Section B, 1990, 46, 795-806
5000169 CIFC6 H11 N OC 1 2/c 119.28; 7.78; 9.57
90; 112.39; 90		1327.27Winkler, F. K.; Dunitz, J. D.
Medium-ring compounds. XIX. Caprolactam: structure refinement
Acta Crystallographica Section B, 1975, 31, 268-269
5000173 CIFC7 H8 OP 1 21/c 15.7; 11.71; 18.13
90; 99.07; 90		1194.99Bois, C.
Structure du p-crésol à basse témperature
Acta Crystallographica Section B, 1970, 26, 2086-2092
5000181 CIFC14 H10P 1 21 18.441; 6.14; 9.438
90; 97.96; 90		484.44Petricek, V.; Cisarova, I.; Hummel, L.; Kroupa, J.; Brezina, B.
Orientational disorder in phenanthrene. Structure determination at 248, 295, 339 and 344 K
Acta Crystallographica Section B, 1990, 46, 830-832
5000183 CIFC H4 N2 SP b n m5.488; 7.663; 8.564
90; 90; 90		360.16Takahashi, I.; Onodera, A.; Shiozaki, Y.
Structural changes of thiourea in connection with its phase transitions: reappraisal of rigidity and libration of the molecule
Acta Crystallographica Section B, 1990, 46, 661-664
5000192 CIFC11 H23 Br OP 1 21 147.1; 5.26; 31.14
90; 132.9; 90		5651.43Rosen, L. S.; Hybl, A.
The crystal structure of 11-bromoundecanol
Acta Crystallographica Section B, 1972, 28, 610-617
5910043 CIF
Paper		C4 H7 N3 O2P 1 21/c 17.728; 9.817; 7.52
90; 100.5; 90		561M. Eisenstein
Static deformation densities for cytosine and adenine
Acta Crystallographica Section B, 1988, 44, 412-426
5910086 CIFK2 O13 W4P -315.566; 15.566; 3.746
90; 90; 120		786.1Okada, K.; Marumo, F.; Iwai, S. I.
The crystal structure of K2 W4 O13
Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3193-3195
5910115 CIF
Paper		C2 H6 OP 1 c 15.377; 6.882; 8.255
90; 102.2; 90		298.6P.-G. Jönsson
Hydrogen bond studies. CXIII. The crystal structure of ethanol at 87 K
Acta Crystallogr.,Sect.B:Struct.Crystallogr.Cryst.Chem., 1976, 32, 232-235
6000092 CIFCo O6 Pb2 WI2/m7.9602; 5.6779; 5.6967
90; 90.047; 90		257.47Baldinozzi, G.; Calvarin, G.; Sciau, P.; Grebille, D.; Suard, E.
Neutron Rietveld refinement of the incommensurate phase of the ordered perovskite Pb2CoWO6
Acta Crystallographica B, 2000, 56, 570-576
6000193 CIF
Paper		C13 H36 Si4F m -3 m12.8902; 12.8902; 12.8902
90; 90; 90		2141.8Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000194 CIF
Paper		C12 H36 Si5F m -3 m13.5218; 13.5218; 13.5218
90; 90; 90		2472.31Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000195 CIF
Paper		C12 H36 Si5P 21 313.17158; 13.17158; 13.17158
90; 90; 90		2285.14Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000196 CIF
Paper		C13 H36 Si4P 21 312.609; 12.609; 12.609
90; 90; 90		2004.7Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000197 CIF
Paper		C13 H36 Si4P a -312.7876; 12.7876; 12.7876
90; 90; 90		2091.06Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander
Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~
Acta Crystallographica Section B, 1999, 55, 1014-1029
6000198 CIF
Paper		C15 H25 N O2 SP 1 21/c 116.96; 8.1382; 11.781
90; 104.777; 90		1572.28Tremayne, Maryjane; MacLean, Elizabeth J.; Tang, Chiu C.; Glidewell, Christopher
2,4,6-Triisopropylbenzenesulfonamide: Monte Carlo structure solution from X-ray powder diffraction data for a molecular system containing four independent asymmetric rotors
Acta Crystallographica Section B, 1999, 55, 1068-1074
6000447 CIFC8 H24 N2 O4 SF11.026; 11.026; 11.026
90; 90; 90		1340.46Malchus, M.; Jansen, M.
Structural investigations of the phase transitions of tetramethylammonium sulfate
Acta Crystallographica B, 1998, 54, 494-502
6000571 CIFCs D O4 SP 1 21/c 17.7801; 8.1392; 7.7219
90; 110.872; 90		456.89Belushkin, A. V.; David, W. I. F.; Ibberson, R. M.; Shuvalov, L. A.
High-resolution neutron powder diffraction studies of the structure of CsDSO4
Acta Crystallographica B, 1991, 47, 161-166
6000576 CIFC D6 I NP b m a7.1743; 7.0967; 8.8323
90; 90; 90		449.69Yamamuro, O.; Matsuo, T.; Suga, H.; David, W. I. F.; Ibberson, R. M.; Leadbetter, A. J.
Neutron-diffraction and calorimetric studies of methylammonium iodide
Acta Crystallographica B, 1992, 48, 329-336
9007500 CIFAg3 As S3C 1 2/c 112; 6.26; 17.08
90; 110; 90		1205.67Engel, P.; Nowacki, W.
Die kristallstruktur von Ag3AsS3
Acta Crystallographica, Section B, 1968, 24, 77-81
9007501 CIFCu H6 O7 SC 1 c 15.592; 13.029; 7.341
90; 97.05; 90		530.808Zahrobsky, R. F.; Baur, W. H.
On the crystal chemistry of salt hydrates. V. The determination of the crystal structure of CuSO4*3H2O (bonattite) Locality: synthetic
Acta Crystallographica, Section B, 1968, 24, 508-513
9007502 CIFFe1.08 H11.25 Mg0.2 Mn0.25 O16 S2 Zn0.47P 1 21/n 110.526; 17.872; 7.136
90; 100.13; 90		1321.5Susse P
Die kristallstruktur des botryogens Locality: Rammelsberg mine near Goslar, Germany
Acta Crystallographica, Section B, 1968, 24, 760-767
9007503 CIFAl4.3 As0.905 Ca0.47 Cu0.06 Fe0.2 H4 Mg Mn3.53 O28 Si5 V0.095P n m m :28.7126; 5.8108; 18.5214
90; 90; 90		937.686Donnay G; Allmann R
Si3O10 groups in the crystal structure of ardennite
Acta Crystallographica, Section B, 1968, 24, 845-855
9007504 CIFAs2 H8 O9P 1 21/c 17.6; 13.29; 8.24
90; 109.6; 90		784.049Worzala, H.
Die kristallstruktur des arsensaurehydrates 2H3AsO4.H2O
Acta Crystallographica, Section B, 1968, 24, 987-991
9007505 CIFCa Cu2.64 H12 O17 S2 Zn1.36C 1 2/c 122.186; 6.25; 21.853
90; 113.36; 90		2781.81Sabelli, C.; Zanazzi, P. F.
The crystal structure of serpierite
Acta Crystallographica, Section B, 1968, 24, 1214-1221
9007506 CIFAl3 B Fe0.1 Mg0.9 O9 SiP b n m10.335; 10.978; 5.76
90; 90; 90		653.516Stephenson, D. A.; Moore, P. B.
The crystal structure of grandidierite, (Mg,Fe)Al3SiBO9
Acta Crystallographica, Section B, 1968, 24, 1518-1522
9007507 CIFB F4 NaC m c m6.8368; 6.2619; 6.7916
90; 90; 90		290.758Brunton, G.
Refinement of the structure of NaBF4
Acta Crystallographica, Section B, 1968, 24, 1703-1704
9007508 CIFB F4 KP n m a8.6588; 5.48; 7.0299
90; 90; 90		333.57Brunton, G.
The crystal structure of KBF4
Acta Crystallographica, Section B, 1969, 25, 2161-2162
9007509 CIFAl2.71 Ca1.9 Fe0.15 H3 Mg0.45 O14 Si2.79A 1 2/m 18.83; 5.9; 19.17
90; 97.12; 90		990.998Galli, E.; Alberti, A.
On the crystal structure of pumpellyite
Acta Crystallographica, Section B, 1969, 25, 2276-2281
9007510 CIFAg5 S4 SbC m c 217.873; 12.467; 8.583
90; 90; 90		842.445Ribar, B.; Nowacki, W.
Die kristallstruktur von stephanit, [SbS3|S|Ag5]
Acta Crystallographica, Section B, 1970, 26, 201-207
9007511 CIFAs2 Ca2 H2 O8P -17.0591; 6.8906; 7.2006
97.43; 103.55; 87.75		337.625Ferraris, G.; Chiari, G.
The crystal structure of CaHAsO4 (weilite)
Acta Crystallographica, Section B, 1970, 26, 403-409
9007512 CIFCa2 H4 Mn O10 P2P -15.79; 6.57; 5.51
102.27; 108.67; 90.3		193.428Fanfani, L.; Nunzi, A.; Zanazzi, P. F.
The crystal structure of fairfieldite
Acta Crystallographica, Section B, 1970, 26, 640-645
9007513 CIFAl H3 O3P -15.114; 5.082; 5.127
70.27; 74; 58.47		106.089Bosmans, H. J.
Unit cell and crystal structure of nordstrandite, Al(OH)3
Acta Crystallographica, Section B, 1970, 26, 649-652
9007514 CIFCu7 S4P n m a7.89; 7.84; 11.01
90; 90; 90		681.052Koto, K.; Morimoto, N.
The crystal structure of anilite
Acta Crystallographica, Section B, 1970, 26, 915-924
9007515 CIFAs H15 Na2 O11P 1 21/n 19.401; 11.025; 10.674
90; 95.5; 90		1101.22Baur, W. H.; Khan, A. A.
On the crystal chemistry of salt hydrates. VI. The crystal structures of disodium hydrogen orthoarsenate heptahydrate and of disodium hydrogen orthophosphate heptahydrate
Acta Crystallographica, Section B, 1970, 26, 1584-1596
9007516 CIFH15 Na2 O11 PP 1 21/n 19.258; 11.007; 10.437
90; 95.61; 90		1058.47Baur, W. H.; Khan, A. A.
On the crystal chemistry of salt hydrates. VI. The crystal structures of disodium hydrogen orthoarsenate heptahydrate and of disodium hydrogen orthophosphate heptahydrate
Acta Crystallographica, Section B, 1970, 26, 1584-1596
9007517 CIFAs Cu3 S4P m n 217.407; 6.436; 6.154
90; 90; 90		293.37Adiwidjaja, G.; Lohn, J.
Strukturverfeinerung von enargit, Cu3AsS4
Acta Crystallographica, Section B, 1970, 26, 1878-1879
9007518 CIFAs Ca H5 O6I 1 a 15.9745; 15.434; 6.2797
90; 114.83; 90		525.525Ferraris, G.; Jones, D. W.; Yerkess, J.
Determination of hydrogen atom positions in the crystal structure of pharmacolite, CaHAsO4(H2O)2, by neutron diffraction
Acta Crystallographica, Section B, 1971, 27, 349-354
9007519 CIFC11 H10 O2 SP 21 21 2118.331; 9.012; 5.949
90; 90; 90		982.769Christensen, A. T.; Thom, E.
The crystal structure of 2-dimenthylsulfuranylidene-1,3-indanedione
Acta Crystallographica, Section B, 1971, 27, 581-586
9007520 CIFMn2 O3P c a b9.4157; 9.4233; 9.4047
90; 90; 90		834.45Geller, S.
Structures of alpha-Mn203, (MnO.983Fe0.017)203 and (Mn0.37Fe0.63)2O3 and relation to magnetic ordering
Acta Crystallographica, Section B, 1971, 27, 821-828
9007521 CIFFe0.034 Mn1.966 O3I a -39.4146; 9.4146; 9.4146
90; 90; 90		834.46Geller, S.
Structures of alpha-Mn203, (MnO.983Fe0.017)203 and (Mn0.37Fe0.63)2O3 and relation to magnetic ordering Sample: (MnO.983Fe0.017)203
Acta Crystallographica, Section B, 1971, 27, 821-828
9007522 CIFFe1.26 Mn0.74 O3I a -39.4126; 9.4126; 9.4126
90; 90; 90		833.928Geller, S.
Structures of alpha-Mn203, (MnO.983Fe0.017)203 and (Mn0.37Fe0.63)2O3 and relation to magnetic ordering Sample: (Mn0.37Fe0.63)2O3
Acta Crystallographica, Section B, 1971, 27, 821-828
9007523 CIFC2 H5 N OR 3 c :H11.526; 11.526; 13.589
90; 90; 120		1563.42Denne, W. A.; Small, R. W. H.
A refinement of the structure of rhombohedral acetamide
Acta Crystallographica, Section B, 1971, 27, 1094-1098
9007524 CIFBi Cu Pb S3P n m a11.608; 4.0279; 11.275
90; 90; 90		527.172Kohatsu, I.; Wuensch, B. J.
The crystal structure of aikinite, PbCuBiS3 Note: B(3,3) altered for Pb and Cu, in order to reproduce Biso
Acta Crystallographica, Section B, 1971, 27, 1245-1252
9007525 CIFAl0.089 Ca3.368 Ce1.048 F3 Fe0.212 K0.064 Na2.178 Nb0.327 O15 Si4 Ti0.515 Zr0.069P 1 21/c 17.437; 5.664; 18.843
90; 101.38; 90		778.122Galli, E.; Alberti, A.
The crystal structure of rinkite
Acta Crystallographica, Section B, 1971, 27, 1277-1284
9007526 CIFO4 Si Zn2I -4 2 d7.0069; 7.0069; 6.4637
90; 90; 90		317.346Marumo, F.; Syono, Y.
The crystal structure of Zn2SiO4-II, a high-pressure phase of willemite
Acta Crystallographica, Section B, 1971, 27, 1868-1870
9007527 CIFH15.479 Na6.335 O32.335 P2P -3 c 111.89; 11.89; 12.671
90; 90; 120		1551.33Tillmanns, E.; Baur, W. H.
On the crystal chemistry of salt hydrates. VII. The crystal structures of pseudo trisodium orthoarsenate dodecahydrate and the isomorphous phosphate and vanadate salts
Acta Crystallographica, Section B, 1971, 27, 2124-2132
9007528 CIFH15.454 Na6.31 O32.31 V2P -3 c 112.038; 12.038; 12.833
90; 90; 120		1610.53Tillmanns, E.; Baur, W. H.
On the crystal chemistry of salt hydrates. VII. The crystal structures of pseudo trisodium orthoarsenate dodecahydrate and the isomorphous phosphate and vanadate salts
Acta Crystallographica, Section B, 1971, 27, 2124-2132
9007529 CIFAs2 H15.404 Na6.26 O32.26P -3 c 112.017; 12.017; 12.783
90; 90; 120		1598.66Tillmanns, E.; Baur, W. H.
On the crystal chemistry of salt hydrates. VII. The crystal structures of pseudo trisodium orthoarsenate dodecahydrate and the isomorphous phosphate and vanadate salts
Acta Crystallographica, Section B, 1971, 27, 2124-2132
9007530 CIFO2 SiP 42/m n m4.179; 4.179; 2.6649
90; 90; 90		46.54Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007531 CIFO2 TiP 42/m n m4.5941; 4.5941; 2.9589
90; 90; 90		62.45Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007532 CIFGe O2P 42/m n m4.3975; 4.3975; 2.8625
90; 90; 90		55.355Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007533 CIFO2 SnP 42/m n m4.738; 4.738; 3.1865
90; 90; 90		71.533Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007534 CIFF2 MgP 42/m n m4.6213; 4.6213; 3.0159
90; 90; 90		64.409Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007535 CIFF2 MnP 42/m n m4.8738; 4.8738; 3.3107
90; 90; 90		78.642Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007536 CIFF2 FeP 42/m n m4.6945; 4.6945; 3.3097
90; 90; 90		72.94Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007537 CIFCo F2P 42/m n m4.6954; 4.6954; 3.1774
90; 90; 90		70.051Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007538 CIFF2 NiP 42/m n m4.6498; 4.6498; 3.0838
90; 90; 90		66.674Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007539 CIFF2 ZnP 42/m n m4.7048; 4.7048; 3.1338
90; 90; 90		69.367Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007540 CIFCr O2P 42/m n m4.421; 4.421; 2.917
90; 90; 90		57.013Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Cloud et al (1962)
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007541 CIFO2 RuP 42/m n m4.4919; 4.4919; 3.1066
90; 90; 90		62.682Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Boman (1970)
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007542 CIFO2 OsP 42/m n m4.5003; 4.5003; 3.1839
90; 90; 90		64.483Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Boman (1970)
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007543 CIFO2 PbP 42/m n m4.9568; 4.9568; 3.3866
90; 90; 90		83.208Baur, W. H.; Khan, A. A.
Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Leciejewicz and Padlo (1962)
Acta Crystallographica, Section B, 1971, 27, 2133-2139
9007544 CIFAs3 Co0.87 Fe0.11 Ni0.13I m -38.195; 8.195; 8.195
90; 90; 90		550.36Mandel, N.; Donohue, J.
The refinement of the crystal structure of skutterudite, CoAs3
Acta Crystallographica, Section B, 1971, 27, 2288-2289
9007545 CIFAs Ca H3 O5P c n b6.904; 16.161; 7.935
90; 90; 90		885.352Ferraris, G.; Jones, D. W.; Yerkess, J.
A neutron and X-ray refinement of the crystal structure of CaHAsO4*H2O (haidingerite) Sample: neutron refinement Locality: synthetic
Acta Crystallographica, Section B, 1972, 28, 209-214
9007546 CIFAs Ca H2 O5P c n b6.904; 16.161; 7.935
90; 90; 90		885.352Ferraris, G.; Jones, D. W.; Yerkess, J.
A neutron and X-ray refinement of the crystal structure of CaHAsO4*H2O (haidingerite) Sample: X-ray refinement Locality: synthetic
Acta Crystallographica, Section B, 1972, 28, 209-214
9007547 CIFCr H4 N Na O6P 21 21 218.413; 13.039; 6.219
90; 90; 90		682.206Khan, A. A.; Baur, W. H.
Salt hydrates. VIII. The crystal structures of sodium ammonium orthochromate dihydrate and magnesium diammonium bis(hydrogen orthophosphate) tetrahydrate and a discussion of the ammonium ion
Acta Crystallographica, Section B, 1972, 28, 683-693
9007548 CIFH10 Mg N2 O12 P2P b c a11.49; 23.66; 8.62
90; 90; 90		2343.38Khan, A. A.; Baur, W. H.
Salt hydrates. VIII. The crystal structures of sodium ammonium orthochromate dihydrate and magnesium diammonium bis(hydrogen orthophosphate) tetrahydrate and a discussion of the ammonium ion
Acta Crystallographica, Section B, 1972, 28, 683-693
9007549 CIFC H6 Mg O6P 1 21/n 17.7053; 5.3673; 12.1212
90; 90.451; 90		501.277Stephan, G. W.; MacGillavry, C. H.
The crystal structure of nesquehonite, MgCO3*3H2O
Acta Crystallographica, Section B, 1972, 28, 1031-1033
9007550 CIFCa Cu4 H12 O17 S2P 1 21/c 120.87; 6.135; 22.191
90; 102.73; 90		2771.44Sabelli, C.; Zanazzi, P. F.
The crystal structure of devillite Note: z-coordinate of Cu7 altered to match reported bond lengths
Acta Crystallographica, Section B, 1972, 28, 1182-1189
9007551 CIFNi5.629 S4.86B m m b3.274; 16.157; 11.359
90; 90; 90		600.869Fleet, M. E.
The crystal structure of alpha-Ni7S6
Acta Crystallographica, Section B, 1972, 28, 1237-1241
9007552 CIFH10 Mg O9 SP -16.314; 10.505; 6.03
81.12; 109.82; 105.08		362.347Baur, W. H.; Rolin, J. L.
Salt hydrates. IX. The comparison of the crystal structure of magnesium sulfate pentahydrate with copper sulfate pentahydrate and magnesium chromate pentahydrate Locality: synthetic
Acta Crystallographica, Section B, 1972, 28, 1448-1455
9007553 CIFF Mn2 O4 PC 1 2/c 113.41; 6.5096; 10.094
90; 119.99; 90		763.169Rea, J. R.; Kostiner, E.
The crystal structure of manganese fluorophosphate, Mn2(PO4)F
Acta Crystallographica, Section B, 1972, 28, 2525-2529
9007554 CIFN Na O3R -3 c :H5.07; 5.07; 16.82
90; 90; 120		374.432Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 20 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007555 CIFN Na O3R -3 c :H5.074; 5.074; 16.97
90; 90; 120		378.367Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 100 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007556 CIFN Na O3R -3 c :H5.077; 5.077; 17.13
90; 90; 120		382.386Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 180 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007557 CIFN Na O3R -3 c :H5.079; 5.079; 17.23
90; 90; 120		384.922Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 230 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007558 CIFN Na O3R -3 c :H5.081; 5.081; 17.27
90; 90; 120		386.119Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 250 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007559 CIFN Na O3R -3 c :H5.082; 5.082; 17.31
90; 90; 120		387.166Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 268 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007560 CIFN Na O3R -3 m :H5.084; 5.084; 8.175
90; 90; 120		182.991Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 290 C
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007561 CIFN Na O3R -3 c :H5.07; 5.07; 16.82
90; 90; 120		374.432Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 20 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007562 CIFN Na O3R -3 c :H5.074; 5.074; 16.97
90; 90; 120		378.367Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 100 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007563 CIFN Na O3R -3 c :H5.077; 5.077; 17.13
90; 90; 120		382.386Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 180 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007564 CIFN Na O3R -3 c :H5.079; 5.079; 17.23
90; 90; 120		384.922Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 230 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007565 CIFN Na O3R -3 c :H5.081; 5.081; 17.27
90; 90; 120		386.119Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 250 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007566 CIFN Na O3R -3 c :H5.082; 5.082; 17.31
90; 90; 120		387.166Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 268 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007567 CIFN Na O3R -3 m :H5.084; 5.084; 8.175
90; 90; 120		182.991Paul, G. L.; Pryor, A. W.
The study of sodium nitrate by neutron diffraction Sample: T = 290 C, refined incorporating curvilinear motion of O atom
Acta Crystallographica, Section B, 1972, 28, 2700-2702
9007568 CIFAl0.7 Ca12.098 F8.4 H13 Mg0.1 Na0.102 O35.6 Si10R -3 :H9.36; 9.36; 36.48
90; 90; 120		2767.82Merlino, S.
The crystal structure of zeophyllite
Acta Crystallographica, Section B, 1972, 28, 2726-2732
9007569 CIFK2 O4 SP n a m7.476; 10.071; 5.763
90; 90; 90		433.901McGinnety, J. A.
Redetermination of the structures of potassium sulphate and potassium chromate: the effect of electrostatic crystal forces upon observed bond length
Acta Crystallographica, Section B, 1972, 28, 2845-2852
9007570 CIFCr K2 O4P n a m7.663; 10.388; 5.922
90; 90; 90		471.41McGinnety, J. A.
Redetermination of the structures of potassium sulphate and potassium chromate: the effect of electrostatic crystal forces upon observed bond length
Acta Crystallographica, Section B, 1972, 28, 2845-2852
9007571 CIFAs H15 Mg O11C 1 2/c 16.6918; 25.744; 11.538
90; 95.15; 90		1979.67Ferraris, G.; Franchini-Angela M
Hydrogen bonding in the crystalline state. Crystal structure of MgHAsO4*7H2O roesslerite Note: B(1,3) of O2 was altered to reproduce axial lengths
Acta Crystallographica, Section B, 1973, 29, 286-292
9007572 CIFCu Fe S2I -4 2 d5.289; 5.289; 10.423
90; 90; 90		291.568Hall, S. R.; Stewart, J. M.
The crystal structure refinement of chalcopyrite, CuFeS2
Acta Crystallographica, Section B, 1973, 29, 579-585
9007573 CIFAs H16 Mg N O10P m n 217.054; 6.205; 11.368
90; 90; 90		497.578Ferraris, G.; Franchini-Angela M
Hydrogen bonding in the crystalline state. Refinement of the crystal structure of MgNH4AsO4*6(H2O), arsenstruvite
Acta Crystallographica, Section B, 1973, 29, 859-863
9007574 CIFNi0.5 Pd Pt2.5 S4P 42/m6.38; 6.38; 6.57
90; 90; 90		267.428Childs, J. D.; Hall, S. R.
The crystal structure of braggite, (Pt,Pd,Ni)S
Acta Crystallographica, Section B, 1973, 29, 1446-1451
9007575 CIFC H6 Cu2 O21 Pb5 S3P m n 2120.089; 7.146; 6.56
90; 90; 90		941.727Giacovazzo, C.; Menchetti, S.; Scordari, F.
The crystal structure of caledonite, Cu2Pb5(SO4)3CO3(OH)6
Acta Crystallographica, Section B, 1973, 29, 1986-1990
9007576 CIFBa6 Cl4.6 Fe0.15 H0.5 Mn2.082 O19 Si6 Ti0.768P 6/m m m16.398; 16.398; 7.2
90; 90; 120		1676.66Kampf, A. R.; Khan, A. A.; Baur, W. H.
Barium chloride silicate with an open framework: verplanckite
Acta Crystallographica, Section B, 1973, 29, 2019-2021
9007577 CIFAl H4 O6 PP 1 21/n 15.178; 9.514; 8.454
90; 90.35; 90		416.466Kniep, R.; Mootz, D.
Metavariscite - A redetermination of its crystal structure
Acta Crystallographica, Section B, 1973, 29, 2292-2294
9007578 CIFBi Cu3 S3P 21 21 217.723; 10.395; 6.716
90; 90; 90		539.164Kocman, V.; Nuffield, E. W.
The crystal structure of wittichenite, Cu3BiS3
Acta Crystallographica, Section B, 1973, 29, 2528-2535
9007579 CIFAs S3 SbP 1 21/a 111.8568; 9.0152; 10.1938
90; 116.365; 90		976.29Guillermo, T. R.; Wuensch, B. J.
The crystal structure of getchellite, AsSbS3
Acta Crystallographica, Section B, 1973, 29, 2536-2541
9007580 CIFH6 N O4 PI -4 2 d7.4997; 7.4997; 7.5494
90; 90; 90		424.62Khan, A. A.; Baur, W. H.
Refinement of the crystal structures of ammonium dihydrogen phosphate and ammonium dihydrogen arsenate Note: known as ADP
Acta Crystallographica, Section B, 1973, 29, 2721-2726
9007581 CIFAs H6 N O4I -4 2 d7.6998; 7.6998; 7.7158
90; 90; 90		457.446Khan, A. A.; Baur, W. H.
Refinement of the crystal structures of ammonium dihydrogen phosphate and ammonium dihydrogen arsenate Note: known as ADA
Acta Crystallographica, Section B, 1973, 29, 2721-2726
9007582 CIFH2 K O4 PP 21 21 217.434; 7.434; 6.945
90; 90; 90		383.811Baur, W. H.
Reconstruction of local atomic environments in the disordered hydrogen-bonded crystal structures of paraelectric ammonium dihydrogen phosphate and potassium dihydrogen phosphate Note: known as KDP Note: polymorph of archerite
Acta Crystallographica, Section B, 1973, 29, 2726-2731
9007583 CIFH6 N O4 PP 21 21 217.4997; 7.4997; 7.5493
90; 90; 90		424.614Baur, W. H.
Reconstruction of local atomic environments in the disordered hydrogen-bonded crystal structures of paraelectric ammonium dihydrogen phosphate and potassium dihydrogen phosphate Note: polymorph of biphosphammite
Acta Crystallographica, Section B, 1973, 29, 2726-2731
9007584 CIFH12 O16 S2 V2P 1 21/c 17.411; 7.439; 12.272
90; 108.9; 90		640.084Theobald, F.; Galy, J.
Structure cristalline de VOSO4((H2O)3 Locality: synthetic Note: polymorph of bobjonesite
Acta Crystallographica, Section B, 1973, 29, 2732-2736
9007585 CIFCu2 O7 V2F d d 220.68; 8.411; 6.448
90; 90; 90		1121.56Mercurio-Lavaud D; Frit, B.
Structure cristalline de la variete basse temperature du pyrovanadate de cuivre: Cu2V2O7 alpha
Acta Crystallographica, Section B, 1973, 29, 2737-2741
9007586 CIFAs2 Fe H5 O10 Pb ZnC 1 2/m 19.124; 6.329; 7.577
90; 115.28; 90		395.637Tillmanns, E.; Gebert, W.
The crystal structure of tsumcorite, a new mineral from the Tsumeb Mine, S.W. Africa Locality: Tsumeb mine, Namibia, Africa
Acta Crystallographica, Section B, 1973, 29, 2789-2794
9007587 CIFO3 Sb2P c c n4.911; 12.464; 5.412
90; 90; 90		331.272Svensson, C.
The crystal structure of orthorhombic antimony trioxide, Sb2O3
Acta Crystallographica, Section B, 1974, 30, 458-461
9007588 CIFCu3 H4 I6 O20P -17.256; 7.9503; 7.8559
105.096; 92.945; 96.952		432.702Ghose, S.; Wan, C.
Structural chemistry of copper and zinc minerals. II. Stereochemistry of copper(II) and iodine(V) in bellingerite, 3Cu(IO3)2.2H2O
Acta Crystallographica, Section B, 1974, 30, 965-974
9007589 CIFAl9 Ba3.5 Ca5.5 H2 K0.5 Na0.5 O55 S3 Si11P -6 2 m13.511; 13.511; 7.462
90; 90; 120		1179.67Merlino, S.
The crystal structure of wenkite
Acta Crystallographica, Section B, 1974, 30, 1262-1266
9007590 CIFSb2 Te3R -3 m :H4.264; 4.264; 30.458
90; 90; 120		479.586Anderson, T. L.; Krause, H. B.
Refinement of the Sb2Te3 and Sb2Te3Se structures and their relationship to nonstoichiometric Sb2Te(3-y)Se(y) compounds Sample: T = 29 C
Acta Crystallographica, Section B, 1974, 30, 1307-1310
9007591 CIFSb2 Se Te2R -3 m :H4.188; 4.188; 29.937
90; 90; 120		454.729Anderson, T. L.; Krause, H. B.
Refinement of the Sb2Te3 and Sb2Te3Se structures and their relationship to nonstoichiometric Sb2Te(3-y)Se(y) compounds Sample: T = 29 C
Acta Crystallographica, Section B, 1974, 30, 1307-1310
9007592 CIFAl3 H4 Na O12 P2P 1 21/n 111.233; 10.142; 7.097
90; 97.37; 90		801.847Gatehouse, B. M.; Miskin, B. K.
The crystal structure of brazilianite, NaAl3(PO4)2(OH)4
Acta Crystallographica, Section B, 1974, 30, 1311-1317
9007593 CIFS8P 1 2/c 18.442; 13.025; 9.356
90; 124.98; 90		842.915Watanabe, Y.
The crystal structure of monoclinic gamma-sulfur
Acta Crystallographica, Section B, 1974, 30, 1396-1401
9007594 CIFAs5 Ca6.25 H20 O30P 1 21/n 117.63; 6.734; 23.47
90; 90.6; 90		2786.22Catti, M.; Ferraris, G.
Crystal structure of Ca5(HAsO4)2(AsO4)2*9H2O (guerinite)
Acta Crystallographica, Section B, 1974, 30, 1789-1794
9007595 CIFO4 Sn WP n n a5.627; 11.6486; 4.9973
90; 90; 90		327.556Jeitschko, W.; Sleight, A. W.
Alpha stannous tungstate: Properties, crystal structure and relationship to ferroelectric SbTaO4 type compounds
Acta Crystallographica, Section B, 1974, 30, 2088-2094
9007596 CIFB3 H15 Mg O13P -18.3479; 10.6068; 6.4447
98.846; 108.981; 105.581		501.239Corazza, E.
The crystal structure of kurnakovite: a refinement
Acta Crystallographica, Section B, 1974, 30, 2194-2199
9007597 CIFF H28 Na7 O27 P2F d -3 c :227.755; 27.755; 27.755
90; 90; 90		21380.8Baur, W. H.; Tillmanns, E.
Salt hydrates. X. The crystal structure determinations of heptasodium fluoride bisphosphate 19-hydrate and heptasodium fluoride bisarsenate 19-hydrate and the computer simulation of the isomorphous vanadate salt Note: not all H were located Locality: synthetic
Acta Crystallographica, Section B, 1974, 30, 2218-2224
9007598 CIFAs2 F H28 Na7 O27F d -3 c :228.12; 28.12; 28.12
90; 90; 90		22235.5Baur, W. H.; Tillmanns, E.
Salt hydrates. X. The crystal structure determination of heptasodium fluoride bisphosphate 19-hydrate and heptasodium fluoride bisarsenate 19-hydrate and the computer simulation of the isomorphous vanadate salt
Acta Crystallographica, Section B, 1974, 30, 2218-2224
9007599 CIFMg2 O7 V2P -113.767; 5.414; 4.912
81.42; 106.82; 130.33		266.795Gopal, R.; Calvo, C.
Crystal structure of magnesium divanadate, Mg2V2O7 Note: There is likely a minor typo in coordinates of O6 because bond lengths cannot be reproduced
Acta Crystallographica, Section B, 1974, 30, 2491-2493
9007600 CIFCo2 O7 V2P 1 21/c 16.594; 8.38; 9.47
90; 100.17; 90		515.069Sauerbrei, E. E.; Faggiani, R.; Calvo, C.
Cobalt vanadate, Co2V2O7, and nickel vanadate, Ni2V2O7
Acta Crystallographica, Section B, 1974, 30, 2907-2909
9007601 CIFNi2 O7 V2P 1 21/c 16.515; 8.303; 9.35
90; 99.86; 90		498.309Sauerbrei, E. E.; Faggiani, R.; Calvo, C.
Cobalt vanadate, Co2V2O7, and nickel vanadate, Ni2V2O7 Note: x-coordinate of O7 altered to reproduce reported bond lengths
Acta Crystallographica, Section B, 1974, 30, 2907-2909
9007602 CIFCl Cu2 H3 O3R -3 :H13.654; 13.654; 14.041
90; 90; 120		2266.98Fleet, M. E.
The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Ordered structure, considered to be the true structure
Acta Crystallographica, Section B, 1975, 31, 183-187
9007603 CIFCl Cu2 H3 O3R -3 :H6.827; 6.827; 14.041
90; 90; 120		566.746Fleet, M. E.
The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Substructure, can be considered as the average structure
Acta Crystallographica, Section B, 1975, 31, 183-187
9007604 CIFCl Cu2 O3R -3 :H6.827; 6.827; 14.041
90; 90; 120		566.746Fleet, M. E.
The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Substructure, with disordered oxygens
Acta Crystallographica, Section B, 1975, 31, 183-187
9007605 CIFAs Fe H4 O6P b c a10.325; 8.953; 10.038
90; 90; 90		927.91Kitahama, K.; Kiriyama, R.; Yoshihisa, B.
Refinement of the crystal structure of scorodite
Acta Crystallographica, Section B, 1975, 31, 322-324
9007606 CIFCu2 O7 V2F d d 220.645; 8.383; 6.442
90; 90; 90		1114.9Calvo, C.; Faggiani, R.
Alpha cupric divanadate
Acta Crystallographica, Section B, 1975, 31, 603-605
9007607 CIFB2 Ca3 O6R -3 c :H8.6377; 8.6377; 11.849
90; 90; 120		765.612Vegas, A.; Cano, F. H.; Garcia-Blanco S
The crystal structure of calcium orthoborate: a redetermination
Acta Crystallographica, Section B, 1975, 31, 1416-1419
9007608 CIFCu H4 Na2 O10 S2P 1 21/c 15.807; 12.656; 5.517
90; 108.32; 90		384.912Hawthorne, F. C.; Ferguson, R. B.
Refinement of the crystal structure of krohnkite
Acta Crystallographica, Section B, 1975, 31, 1753-1755
9007609 CIFO3 Sb2F d -3 m :111.1519; 11.1519; 11.1519
90; 90; 90		1386.91Svensson, C.
Refinement of the crystal structure of cubic antiomony trioxide, Sb2O3
Acta Crystallographica, Section B, 1975, 31, 2016-2018
9007610 CIFLi0.55 Mn4 Na0.45 O15 Si5P -17.621; 11.761; 6.731
92.767; 95.083; 106.867		573.345Narita, H.; Koto, K.; Morimoto, N.; Yoshii, M.
The crystal structure of nambulite (Li,Na)Mn4Si5O14(OH)
Acta Crystallographica, Section B, 1975, 31, 2422-2426
9007611 CIFCa3 H6 O10 Si2C 1 c 116.278; 5.6321; 13.236
90; 134.898; 90		859.577Malik, K. M. A.; Jeffery, J. W.
A re-investigation of the structure of afwillite
Acta Crystallographica, Section B, 1976, 32, 475-480
9007612 CIFB3 H15 Mg O13P 1 21/c 16.8221; 13.1145; 12.035
90; 104.552; 90		1042.21Corazza, E.
Inderite: Crystal structure refinement and relationship to kurnakovite
Acta Crystallographica, Section B, 1976, 32, 1329-1333
9007613 CIFAs H9 Mg O8P b c a7.472; 10.891; 16.585
90; 90; 90		1349.65Protas, J.; Gindt, R.
Structure cristalline de la brassite, MgHAsO4*4H2O, produit de deshydratation de la roesslerite Locality: synthetic
Acta Crystallographica, Section B, 1976, 32, 1460-1466
9007614 CIFAs3 Ca2 Mg1.7 Mn0.3 Na O12I a -3 d12.355; 12.355; 12.355
90; 90; 90		1885.94Hawthorne, F. C.
Refinement of the crystal structure of berzeliite Note: garnet structure
Acta Crystallographica, Section B, 1976, 32, 1581-1583
9007615 CIFBi5 Cu Pb S9P b n m33.531; 11.486; 4.003
90; 90; 90		1541.7Kohatsu, I.; Wuensch, B. J.
The crystal structure of gladite, PbCuBi5S9, a superstructure intermediate in the series Bi2S3-PbCuBiS3 (bismuthinite-aikinite)
Acta Crystallographica, Section B, 1976, 32, 2401-2409
9007616 CIFCa0.017 Fe0.614 Li0.301 Mg0.036 Mn0.333 Na0.014 O4 P0.965P m n b5.918; 10.037; 4.798
90; 90; 90		284.996Alberti, A.
Crystal structure of ferrisicklerite, Li<1(Fe3+,Mn2+)PO4
Acta Crystallographica, Section B, 1976, 32, 2761-2764
9007617 CIFO4 Pb WP 1 21/a 113.555; 4.976; 5.561
90; 107.63; 90		357.471Fujita, T.; Kawada, I.; Kato, K.
Raspite from Broken Hill
Acta Crystallographica, Section B, 1977, 33, 162-164
9007618 CIFAl H4 O6 PP b c a9.822; 8.561; 9.63
90; 90; 90		809.75Kniep, R.; Mootz, D.; Vegas, A.
Variscite
Acta Crystallographica, Section B, 1977, 33, 263-265
9007619 CIFCa4 H4 O16 P4P -16.91; 6.627; 6.998
96.34; 103.82; 88.33		309.275Catti, M.; Ferraris, G.; Filhol, A.
Hydrogen bonding in the crystalline state. CaHPO4 (monetite), P-1 or P1? A novel neutron diffraction study
Acta Crystallographica, Section B, 1977, 33, 1223-1229
9007620 CIFC4 H10 Mg5 O18P 1 21/c 110.105; 8.954; 8.378
90; 114.44; 90		690.118Akao, M.; Iwai, S.
The hydrogen bonding of hydromagnesite
Acta Crystallographica, Section B, 1977, 33, 1273-1275
9007621 CIFAs2 Ca Fe O7 SbI 41/a :216.144; 16.144; 10.706
90; 90; 90		2790.29Coda, A.; Dal Negro, A.; Sabelli, C.; Tazzoli, V.
The crystal structure of stenhuggarite
Acta Crystallographica, Section B, 1977, 33, 1807-1811
9007622 CIFAl2 Ba0.24 H10 K0.01 O21 Si6 Sr0.71P 1 21/m 16.793; 17.573; 7.759
90; 94.54; 90		923.312Schlenker, J. L.; Pluth, J. J.; Smith, J. V.
Refinement of the crystal structure of brewsterite, Ba0.5Sr1.5Al4Si12O32*10H2O
Acta Crystallographica, Section B, 1977, 33, 2907-2910
9007623 CIFC0.5 H4 Mg O4C 1 2/m 116.56; 3.153; 6.231
90; 99.1; 90		321.249Akao, M.; Iwai, S.
The hydrogen bonding of artinite Note: anisotropic displacement parameters obtained from ICSD
Acta Crystallographica, Section B, 1977, 33, 3951-3953
9007624 CIFO4 Si ThI 41/a m d :27.1328; 7.1328; 6.3188
90; 90; 90		321.481Taylor, M.; Ewing, R. C.
The crystal structure of the ThSiO4 polymorphs: huttonite and thorite
Acta Crystallographica, Section B, 1978, 34, 1074-1079
9007625 CIFO4 Si ThP 1 21/n 16.784; 6.974; 6.5
90; 104.92; 90		297.158Taylor, M.; Ewing, R. C.
The crystal structure of the ThSiO4 polymorphs: huttonite and thorite
Acta Crystallographica, Section B, 1978, 34, 1074-1079
9007626 CIFAl2 H18 O15 SP 1 21/c 17.44; 15.583; 11.7
90; 110.18; 90		1273.2Sabelli, C.; Ferroni, R. T.
The crystal structure of aluminite Note: anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1978, 34, 2407-2412
9007627 CIFO4 Si Zn2R -3 :H13.948; 13.948; 9.315
90; 90; 120		1569.41Klaska, K.-H.; Eck, J. C.; Pohl, D.
New investigation of willemite Note: Anisotropic displacement parameters are from ICSD
Acta Crystallographica, Section B, 1978, 34, 3324-3325
9007628 CIFAs2 Cu3 H2 O10 PbC 1 2/c 110.147; 5.892; 14.081
90; 106.05; 90		809.034Ghose, S.; Wan, C.
Structural chemistry of copper and zinc minerals. VI. Bayldonite, (Cu,Zn)3Pb(AsO4)2(OH)2: A complex layer structure
Acta Crystallographica, Section B, 1979, 35, 819-823
9007629 CIFAs H Mn4 O13 Si3P 1 21/n 16.66; 19.92; 7.67
90; 95.7; 90		1012.53Gramaccioli, C. M.; Pilati, T.; Liborio, G.
Structure of a manganese(II) arsenatotrisilicate, Mn4[AsSi3O12(OH)]: The presence of a new tetrapolyphosphate-like anion Note: Displacement parameters taken from ICSD
Acta Crystallographica, Section B, 1979, 35, 2287-2291
9007630 CIFBa5 Cl O12 P3P 63/m10.284; 10.284; 7.651
90; 90; 120		700.766Hata, M.; Marumo, F.; Iwai, S.; Aoki, H.
Structure of barium chlorapatite
Acta Crystallographica, Section B, 1979, 35, 2382-2384
9007631 CIFAl Cl Cu H28 O22 S2P -16.282; 13.192; 6.26
91.85; 94.7; 82.46		512.443Ginderow, D.; Cesbron, F.
Structure cristalline de l'aubertite, AlCuCl(SO4)2*14H2O Note: anisotropic displacement parameters obtained from ICSD
Acta Crystallographica, Section B, 1979, 35, 2499-2502
9007632 CIFH7 Mg O7 PP b c a10.203; 10.678; 10.015
90; 90; 90		1091.11Abbona, F.; Boistelle, R.; Haser, R.
Hydrogen bonding in MgHPO4*3H2O (newberyite)
Acta Crystallographica, Section B, 1979, 35, 2514-2518
9007633 CIFAl2 H6 K Na O10.765 Si2I 1 2 110.226; 10.422; 9.884
90; 88.19; 90		1052.86Alberti, A.; Vezzalini, G.
The crystal structure of amicite, a zeolite
Acta Crystallographica, Section B, 1979, 35, 2866-2869
9007634 CIFAl2 O3R -3 c :H4.754; 4.754; 12.99
90; 90; 120		254.248Ishizawa, N.; Miyata, T.; Minato, I.; Marumo, F.; Iwai, S.
A structural investigation of alpha-Al2O3 at 2170 K T = 300 K
Acta Crystallographica, Section B, 1980, 36, 228-230
9007635 CIFAl2 O3R -3 c :H4.844; 4.844; 13.27
90; 90; 120		269.656Ishizawa, N.; Miyata, T.; Minato, I.; Marumo, F.; Iwai, S.
A structural investigation of alpha-Al2O3 at 2170 K T = 2170 K
Acta Crystallographica, Section B, 1980, 36, 228-230
9007636 CIFCa2 H K2 Na O20 Si7 TiP -110.377; 12.166; 7.059
90.91; 99.3; 92.76		878.187Bissert, G.
Verfeinerung der struktur von tinaksit, Ca2K2NaTiO[Si7O18(OH)] Note: z-coordinate of Si4 adjusted to match reported bond lengths
Acta Crystallographica, Section B, 1980, 36, 259-263
9007637 CIFAs O2P n m a8.597; 5.235; 7.269
90; 90; 90		327.143Jones, P. G.; Beesk, W.; Sheldrick, G. M.; Schwarzmann, E.
Arsenic dioxide
Acta Crystallographica, Section B, 1980, 36, 439-440
9007638 CIFK Na O4 SP 3 m 15.6066; 5.6066; 7.177
90; 90; 120		195.377Okada, K.; Ossaka, J.
Structures of potassium sodium sulphate and tripotassium sodium disulphate
Acta Crystallographica, Section B, 1980, 36, 919-921
9007639 CIFK3 Na O8 S2P -3 m 15.6801; 5.6801; 7.309
90; 90; 120		204.221Okada, K.; Ossaka, J.
Structures of potassium sodium sulphate and tripotassium sodium disulphate
Acta Crystallographica, Section B, 1980, 36, 919-921
9007640 CIFNi3 S2R 3 2 :R4.0718; 4.0718; 4.0718
89.459; 89.459; 89.459		67.5Parise, J. B.
Structure of hazelwoodite (Ni3S2)
Acta Crystallographica, Section B, 1980, 36, 1179-1180
9007641 CIFH42 Mg9 Mn1.882 O42 S2 Zn4P 1 21/a 111.147; 20.35; 8.202
90; 92.69; 90		1858.5Hill, R. J.
The structure of mooreite Note: Isotropic and anisotropic displacement factors taken from ICSD
Acta Crystallographica, Section B, 1980, 36, 1304-1311
9007642 CIFCa Cl6 H24 Mg2 O12R -3 :H10.136; 10.136; 17.318
90; 90; 120		1540.85Clark, J. R.; Evans, H. T.; Erd, R. C.
Tachyhydrite, dimagnesium calcium chloride 12-hydrate
Acta Crystallographica, Section B, 1980, 36, 2736-2739
9007643 CIFC O2P a -35.624; 5.624; 5.624
90; 90; 90		177.884Simon, A.; Peters, K.
Single-crystal refinement of the structure of carbon dioxide Sample: T = 150 K
Acta Crystallographica, Section B, 1980, 36, 2750-2751
9007644 CIFFe3 O4F d -3 m :28.3941; 8.3941; 8.3941
90; 90; 90		591.456Fleet, M. E.
The structure of magnetite
Acta Crystallographica, Section B, 1981, 37, 917-920
9007645 CIFC3 H10 Ca Na2 O16 UR -3 m :H17.902; 17.902; 23.734
90; 90; 120		6587.26Coda, A.; Della Giusta, A.; Tazzoli, V.
The structure of synthetic andersonite, Na2Ca[UO2(CO3)3].x(H2O) (x~5.6) Note: anisotropic displacement factors are from ICSD Note: B(2,2) for C2 changed to reproduce Biso and make positive definite
Acta Crystallographica, Section B, 1981, 37, 1496-1500
9007646 CIFBa0.1 Fe0.52 K0.66 Mg0.12 Na0.02 O8 Ti3.36I 4/m10.139; 10.139; 2.9664
90; 90; 90		304.944Post, J. E.; Von Dreele, R. B.; Buseck, P. R.
Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: Anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1982, 38, 1056-1065
9007647 CIFAl0.08 Fe0.16 K0.65 Mn3.76 Na0.11 O8 Sr0.08I 1 2/m 19.956; 2.8705; 9.706
90; 90.95; 90		277.347Post, J. E.; Von Dreele, R. B.; Buseck, P. R.
Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: -1M polytype Note: Anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1982, 38, 1056-1065
9007648 CIFAl0.12 Ba0.34 Fe0.64 Mn3.24 O8 Pb0.08I 1 2/m 110.026; 2.8782; 9.729
90; 91.03; 90		280.703Post, J. E.; Von Dreele, R. B.; Buseck, P. R.
Symmetry and cation displacements in hollandites: structure refinements of hollandite, cryptomelane and priderite Note: Anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1982, 38, 1056-1065
9007649 CIFNa0.5 O13 Si3 Y4.5P 63/m9.334; 9.334; 6.759
90; 90; 120		509.975Gunawardane, R. P.; Howie, R. A.; Glasser, F. P.
Structure of the oxyapatite NaY9(SiO4)6O2 Note: apatite structure
Acta Crystallographica, Section B, 1982, 38, 1564-1566
9007650 CIFFe SP -6 2 c5.963; 5.963; 11.754
90; 90; 120		361.948King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 0.0001 GPa
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007651 CIFFe SP -6 2 c5.999; 5.999; 11.71
90; 90; 120		364.96King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 393 K, P = 0.0001 GPa
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007652 CIFFe SP -6 2 c5.861; 5.861; 11.577
90; 90; 120		344.406King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 3.33 GPa
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007653 CIFFe SP n m a5.825; 3.4675; 6.0059
90; 90; 90		121.308King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 463 K, P = 0.0001 GPa, MnP-type structure
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007654 CIFFe SP n m a5.716; 3.347; 5.797
90; 90; 90		110.905King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 4.15 GPa, MnP-type structure Note: a cell edge altered from value reported
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007655 CIFFe SP n m a5.65; 3.3155; 5.7426
90; 90; 90		107.574King, Jr, H. E.; Prewitt, C. T.
High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 6.35 GPa, MnP-type structure
Acta Crystallographica, Section B, 1982, 38, 1877-1887
9007656 CIFC2 H5 Na3 O8C 1 2/c 120.36; 3.48; 10.29
90; 106.48; 90		699.124Choi, C. S.; Mighell, A. D.
Neutron diffraction study of sodium sesquicarbonate dihydrate Note: H3 disordered model, this is the prefered model
Acta Crystallographica, Section B, 1982, 38, 2874-2876
9007657 CIFC2 H5 Na3 O8C 1 2/c 120.36; 3.48; 10.29
90; 106.48; 90		699.124Choi, C. S.; Mighell, A. D.
Neutron diffraction study of sodium sesquicarbonate dihydrate Note: H3 ordered model, this is least favoured
Acta Crystallographica, Section B, 1982, 38, 2874-2876
9007658 CIFB5 Ca H10 Na O14P 1 21/c 16.588; 12.56; 13.428
90; 99.97; 90		1094.32Menchetti, S.; Sabelli, C.; Trosti-Ferroni R
Probertite, CaNa[B5O7(OH)4]*3H2O: a refinement
Acta Crystallographica, Section B, 1982, 38, 3072-3075
9007659 CIFNi53 S54P 31 2 110.29; 10.29; 15.993
90; 90; 120		1466.53Collin, G.; Chavant, C.; Comes, R.
Structure and planar faults in the defective NiAs-type compound Ni17S18
Acta Crystallographica, Section B, 1983, 39, 289-296
9007660 CIFMo S2P 63/m m c3.161; 3.161; 12.295
90; 90; 120		106.392Schonfeld, B.; Huang, J. J.; Moss, S. C.
Anisotropic mean-square displacements (MSD) in single crystals of 2H- and 3R-MoS2 Note: 2H polytype, this is the most common in nature
Acta Crystallographica, Section B, 1983, 39, 404-407
9007661 CIFMo S2R 3 m :H3.163; 3.163; 18.37
90; 90; 120		159.162Schonfeld, B.; Huang, J. J.; Moss, S. C.
Anisotropic mean-square displacements (MSD) in single crystals of 2H- and 3R-MoS2 Note: 3R polytype
Acta Crystallographica, Section B, 1983, 39, 404-407
9007662 CIFAs CoP n a m5.2857; 5.8675; 3.4883
90; 90; 90		108.186Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pnam refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007663 CIFAs CoP n a 215.2857; 5.8675; 3.4883
90; 90; 90		108.186Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pna2_1 refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007664 CIFAs CoP n a m5.2675; 5.815; 3.4623
90; 90; 90		106.052Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 2.80 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007665 CIFAs CoP n a m5.2631; 5.801; 3.4569
90; 90; 90		105.543Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 3.70 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007666 CIFAs CoP n a m5.2575; 5.7782; 3.4453
90; 90; 90		104.664Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 4.90 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007667 CIFAs FeP n a 215.4401; 6.0259; 3.3712
90; 90; 90		110.513Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pna2_1 refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007668 CIFAs FeP n a m5.4401; 6.0259; 3.3712
90; 90; 90		110.513Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: Pnam refinement, P = .0001 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007669 CIFAs FeP n a m5.424; 5.9948; 3.3386
90; 90; 90		108.557Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 2.25 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007670 CIFAs FeP n a m5.411; 5.9671; 3.3122
90; 90; 90		106.944Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 4.36 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007671 CIFAs FeP n a m5.403; 5.9488; 3.2902
90; 90; 90		105.752Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 6.10 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007672 CIFAs FeP n a m5.39; 5.928; 3.2662
90; 90; 90		104.361Lyman, P. S.; Prewitt, C. T.
Room- and high-pressure crystal chemistry of CoAs and FeAs Note: anisoB's taken from ICSD Sample: P = 8.3 GPa
Acta Crystallographica, Section B, 1984, 40, 14-20
9007673 CIFMn O3 TiR -3 :H5.139; 5.139; 14.283
90; 90; 120		326.669Kidoh, K.; Tanaka, K.; Marumo, F.; Takei, H.
Electron density distribution in ilmenite-type crystals. II. Manganese (II) titanium (IV) trioxide Sample: ilmenite structure
Acta Crystallographica, Section B, 1984, 40, 329-332
9007674 CIFH16 Mg N O10 PP m n 216.955; 6.142; 11.218
90; 90; 90		479.206Ferraris, G.; Fuess, H.; Joswig, W.
Neutron diffraction study of MgNH4PO4*6H2O (struvite) and survey of water molecules donating short hydrogen bonds
Acta Crystallographica, Section B, 1986, 42, 253-258
9007675 CIFB H3 O3P -17.0187; 7.035; 6.3472
92.49; 101.46; 119.76		262.901Gajhede, M.; Larsen, S.; Rettrup, S.
Electron density of orthoboric acid determined by X-ray diffraction at 105 K and ab initio calculations Note: multipole refinement
Acta Crystallographica, Section B, 1986, 42, 545-552
9007676 CIFAl1.5 H4 Na1.875 O6.125 S1.125 Si1.5I -4 3 m9.0338; 9.0338; 9.0338
90; 90; 90		737.244Tarling, S. E.; Barnes, P.; Klinowski, J.
The structure and Si,Al distribution of the ultramarines Note: disordered synthetic counterpart to lazurite Note: occupancies changed to match formula
Acta Crystallographica, Section B, 1988, 44, 128-135
9007677 CIFAs3 Ni8.499 O16R -3 m :R9.8105; 9.8105; 9.8105
35.312; 35.312; 35.312		281.837Fleet, M. E.; Barbier, J.
Structure of aerugite (Ni8.5As3O16) and interrelated arsenate and germanate structural series
Acta Crystallographica, Section B, 1989, 45, 201-205
9007678 CIFGe3 Mg5.467 Ni4.533 O16R -3 m :R10.125; 10.125; 10.125
33.79; 33.79; 33.79		286.075Fleet, M. E.; Barbier, J.
Structure of aerugite (Ni8.5As3O16) and interrelated arsenate and germanate structural series
Acta Crystallographica, Section B, 1989, 45, 201-205
9007679 CIFK O5 P TiP n a 2112.819; 6.399; 10.584
90; 90; 90		868.193Thomas, P. A.; Glazer, A. M.; Watts, B. E.
Crystal structure and nonlinear optical properties of KSnOPO4 and their comparison with KTiOPO4 Note: KTP structure
Acta Crystallographica, Section B, 1990, 46, 333-343
9007680 CIFK O5 P SnP n a 2113.145; 6.526; 10.738
90; 90; 90		921.151Thomas, P. A.; Glazer, A. M.; Watts, B. E.
Crystal structure and nonlinear optical properties of KSnOPO4 and their comparison with KTiOPO4 Note: KTP structure
Acta Crystallographica, Section B, 1990, 46, 333-343
9007681 CIFC4 H3 Na5 O12P -13.4762; 10.0393; 15.5969
107.77; 95.589; 95.028		511.906Fernandes, N. G.; Tellgren, R.; Olovsson, I.
Structure and electron density of pentasodium trihydrogentetracarbonate Note: anisotropic displacement factors from ICSD
Acta Crystallographica, Section B, 1990, 46, 466-474
9007682 CIFCo S2P a -35.5385; 5.5385; 5.5385
90; 90; 90		169.893Nowack, E.; Schwarzenbach, D.; Hahn, T.
Charge densities in CoS2 and NiS2 (pyrite structure) Note: multipole model
Acta Crystallographica, Section B, 1991, 47, 650-659
9007683 CIFNi S2P a -35.6765; 5.6765; 5.6765
90; 90; 90		182.912Nowack, E.; Schwarzenbach, D.; Hahn, T.
Charge densities in CoS2 and NiS2 (pyrite structure) Note: multipole model, T = 135 K
Acta Crystallographica, Section B, 1991, 47, 650-659
9007684 CIFAs2 Ni3 O8P 1 21/c 15.764; 9.559; 10.194
90; 92.95; 90		560.925Barbier, J.; Frampton, C.
Structures of orthorhombic and monoclinic Ni3(AsO4)2 Note: AnisoU's taken from ICSD
Acta Crystallographica, Section B, 1991, 47, 457-462
9007685 CIFAs2 Ni3 O8C m c e5.943; 11.263; 8.164
90; 90; 90		546.466Barbier, J.; Frampton, C.
Structures of orthorhombic and monoclinic Ni3(AsO4)2 Note: AnisoU's taken from ICSD Note: polymorph of xanthiosite
Acta Crystallographica, Section B, 1991, 47, 457-462
9007689 CIFC Ca O3R -3 c :H4.988; 4.988; 17.068
90; 90; 120		367.761Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.
Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3
Acta Crystallographica, Section B, 1995, 51, 929-939
9007690 CIFC Mn O3R -3 c :H4.772; 4.772; 15.637
90; 90; 120		308.379Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.
Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3 Sample: Synchrotron data
Acta Crystallographica, Section B, 1995, 51, 929-939
9007692 CIFC Mg O3R -3 c :H4.632; 4.632; 15.002
90; 90; 120		278.751Maslen, E. N.; Streltsov, V. A.; Streltsova, N. R.; Ishizawa, N.
Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3
Acta Crystallographica, Section B, 1995, 51, 929-939
9007694 CIFCo0.06 Cu0.68 Fe0.11 Ni0.15 S2P 1 21 15.709; 5.707; 5.708
90; 90.01; 90		185.974Marcos, C.; Paniagua, A.; Moreiras, D. B.; Garcia-Granda S; Diaz, M. R.
Villamaninite, a case of noncubic pyrite-type structure Sample: 1 Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1996, 52, 899-904
9007695 CIFCo0.13 Cu0.53 Fe0.07 Ni0.27 S2P 1 21 15.704; 5.703; 5.704
90; 89.99; 90		185.551Marcos, C.; Paniagua, A.; Moreiras, D. B.; Garcia-Granda S; Diaz, M. R.
Villamaninite, a case of noncubic pyrite-type structure Sample: 2 Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1996, 52, 899-904
9007697 CIFCu6 O8 PbF m -3 m9.314; 9.314; 9.314
90; 90; 90		807.995Winkler, B.; Chall, M.; Pickard, C. J.; Milman, V.; White, J.
Structure of Cu6PbO8 Note: these are model structure derived from quantum calculations This model appears to be the stable phase at ambient conditions
Acta Crystallographica, Section B, 2000, 56, 22-26
9007698 CIFCu6 O8 PbF m -3 m8.623; 8.623; 8.623
90; 90; 90		641.173Winkler, B.; Chall, M.; Pickard, C. J.; Milman, V.; White, J.
Structure of Cu6PbO8 Note: these are model structure derived from quantum calculations This model appears to be the stable phase at high pressure
Acta Crystallographica, Section B, 2000, 56, 22-26
9007701 CIFAl2 Mn3 O12 Si3I a -3 d11.63; 11.63; 11.63
90; 90; 90		1573.04Gramaccioli, C. M.; Pilati, T.; Demartin, F.
Atomic displacement parameters for spessartine Mn3Al2Si3O12 and their lattice-dynamical interpretation
Acta Crystallographica, Section B, 2002, 58, 965-969
9011080 CIFCl2 Hg3 S2I 21 38.949; 8.949; 8.949
90; 90; 90		716.677Frueh, A. J.; Gray, N.
Confirmation and refinement of the structure of Hg3S2Cl2
Acta Crystallographica, Section B, 1968, 24, 156-157
9011083 CIFAl Cl3 H12 O6R -3 c :H11.827; 11.827; 11.895
90; 90; 120		1440.94Buchanan, D. R.; Harris, P. M.
A neutron and X-ray diffraction investigation of aluminium chloride hexahydrate Locality: synthetic Sample: single crystal X-ray diffraction data
Acta Crystallographica, Section B, 1968, 24, 954-960
9011085 CIFNa2 O5 Si2P 1 21/a 112.329; 4.848; 8.133
90; 104.24; 90		471.181Pant, A. K.
A reconsideration of the crystal structure of beta-Na2Si2O5
Acta Crystallographica, Section B, 1968, 24, 1077-1083
9011086 CIFCl Hg1.5 SA 2 m m4.664; 16.82; 9.081
90; 90; 90		712.391Durovic, S.
The crystal structure of gamma-Hg3S2Cl2 Sample: one-layer structure used for interatomic functions
Acta Crystallographica, Section B, 1968, 24, 1661-1670
9011088 CIFCl Hg1.5 SP b m m9.328; 8.41; 4.5405
90; 90; 90		356.195Durovic, S.
The crystal structure of gamma-Hg3S2Cl2 Sample: superposition structure
Acta Crystallographica, Section B, 1968, 24, 1661-1670
9011089 CIFGaC 1 2/c 12.766; 8.053; 3.332
90; 92.02; 90		74.173Bosio, L.; Defrain, A.; Curien, H.; Rimsky, A.
Structure cristalline du gallium-beta Sample: at T = 248.15 K Note: structure known as beta phase
Acta Crystallographica, Section B, 1969, 25, 995-995
9011090 CIFFe7 O10 SiP 1 21/m 121.4; 3.06; 5.88
90; 98; 90		381.299Smuts, J.; Steyn, J. G. D.; Boeyens, J. C. A.
The crystal structure of an iron silicate, iscorite
Acta Crystallographica, Section B, 1969, 25, 1251-1255
9011091 CIFCa5 H O13 P3P 63/m9.424; 9.424; 6.879
90; 90; 120		529.086Sudarsanan, K.; Young, R. A.
Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-4
Acta Crystallographica, Section B, 1969, 25, 1534-1543
9011092 CIFCa5 H O13 P3P 63/m9.424; 9.424; 6.879
90; 90; 120		529.086Sudarsanan, K.; Young, R. A.
Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-6
Acta Crystallographica, Section B, 1969, 25, 1534-1543
9011093 CIFCa5 H O13 P3P 63/m9.424; 9.424; 6.879
90; 90; 120		529.086Sudarsanan, K.; Young, R. A.
Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-10
Acta Crystallographica, Section B, 1969, 25, 1534-1543
9011094 CIFCa5 H O13 P3P 63/m9.424; 9.424; 6.879
90; 90; 120		529.086Sudarsanan, K.; Young, R. A.
Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: Neutron
Acta Crystallographica, Section B, 1969, 25, 1534-1543
9011099 CIFCl Fe2 O12 Te4P -18.89; 5.08; 6.63
103.17; 107.08; 77.87		275.366Dusausoy, Y.; Protas, J.
Determination et etude de la structure cristalline de la rodalquilarite, chlorotellurite acide de fer
Acta Crystallographica, Section B, 1969, 25, 1551-1558
9011100 CIFC H30 Ca3 Mn O25 SP 6311.06; 11.06; 10.5
90; 90; 120		1112.32Granger, M. M.; Protas, J.
Determination et etude de la structure cristalline de la jouravskite Ca3MnIV(SO4)(CO3)(OH)*12(H2O)
Acta Crystallographica, Section B, 1969, 25, 1943-1951
9011101 CIFB5 H4 N O10P 1 21/c 19.47; 7.63; 11.65
90; 97.08; 90		835.365Merlino, S.; Sartori, F.
The crystal structure of lardellite, NH4B5O7(OH)2*H2O
Acta Crystallographica, Section B, 1969, 25, 2264-2270
9011102 CIFC H20 Na2 O13C 1 c 112.83; 9.026; 13.44
90; 123; 90		1305.31Taga, T.
Crystal structure of Na2CO3*10H2O
Acta Crystallographica, Section B, 1969, 25, 2656-2657
9011103 CIFAl2 Ca6 H66 O49.68 S3P 3 1 c11.26; 11.26; 21.48
90; 90; 120		2358.53Moore, A. E.; Taylor, H. F. W.
Crystal structure of ettringite
Acta Crystallographica, Section B, 1970, 26, 386-393
9011104 CIFO7 Si2 Yb2C 1 2/m 16.802; 8.875; 4.703
90; 102.12; 90		277.581Smolin, Y. I.; Shepelev, Y. F.
The crystal structures of the rare earth pyrosilicates
Acta Crystallographica, Section B, 1970, 26, 484-492
9011105 CIFEr2 O7 Si2P 1 1 21/b4.683; 5.556; 10.79
90; 90; 96		279.204Smolin, Y. I.; Shepelev, Y. F.
The crystal structures of the rare earth pyrosilicates
Acta Crystallographica, Section B, 1970, 26, 484-492
9011106 CIFGd2 O7 Si2P n a 2113.87; 5.073; 8.33
90; 90; 90		586.12Smolin, Y. I.; Shepelev, Y. F.
The crystal structures of the rare earth pyrosilicates
Acta Crystallographica, Section B, 1970, 26, 484-492
9011107 CIFNd2 O7 Si2P 21 21 215.394; 12.95; 8.72
90; 90; 90		609.112Smolin, Y. I.; Shepelev, Y. F.
The crystal structures of the rare earth pyrosilicates
Acta Crystallographica, Section B, 1970, 26, 484-492
9011108 CIFMnI -4 3 m8.911; 8.911; 8.911
90; 90; 90		707.586Oberteuffer, J. A.; Ibers, J. A.
A refinement of the atomic and thermal parameters of alpha-manganese from a single crystal
Acta Crystallographica, Section B, 1970, 26, 1499-1504
9011109 CIFB35R -3 m :R10.17; 10.17; 10.17
65.12; 65.12; 65.12		826.857Geist, D.; Kloss, R.; Follner, H.
Verfeinerung des beta-rhomboedrischen bors
Acta Crystallographica, Section B, 1970, 26, 1800-1802
9011110 CIFO9 Te3 UP a -311.37; 11.37; 11.37
90; 90; 90		1469.88Galy, J.; Meunier, G.
A propos de la cliffordite UTe3O8. Le Systeme UO3-TeO2 a 700 C. Structure cristalline de UTe3O9 Sample: T = 700 C
Acta Crystallographica, Section B, 1971, 27, 608-616
9011111 CIFB2 Ca H12 O10C 1 2/c 116.07999; 6.69; 7.95
90; 104.9; 90		826.466Sedlacek, P.; Dornberger-Schiff K
An OD-Disordered modification of the calcium monoborate dihydrate Ca[B(OH)4]2*2H2O Sample: MDO (1)
Acta Crystallographica, Section B, 1971, 27, 1532-1541
9011112 CIFB2 Ca H12 O10P 1 2/c 18.04; 6.69; 7.95
90; 104.9; 90		413.233Sedlacek, P.; Dornberger-Schiff K
An OD-Disordered modification of the calcium monoborate dihydrate Ca[B(OH)4]2*2H2O Sample: MDO (2)
Acta Crystallographica, Section B, 1971, 27, 1532-1541
9011113 CIFAl Ca2 Fe O5I b m 25.584; 14.6; 5.374
90; 90; 90		438.123Colville, A. A.; Geller, S.
The crystal structure of brownmillerite, Ca2FeAlO5 Note: no bond lengths could be reproduced
Acta Crystallographica, Section B, 1971, 27, 2311-2315
9011114 CIFC5 H7 N5 O2P 1 21/n 116.51; 11.277; 3.645
90; 96.8; 90		673.864Thewalt, U.; Bugg, C. E.; Marsh, R. E.
The crystal structure of guanine monohydrate
Acta Crystallographica, Section B, 1971, 27, 2358-2362
9011115 CIFK2 Mg5 O30 Si12P 6/m c c10.222; 10.222; 14.152
90; 90; 120		1280.62Khan, A. A.; Baur, W. H.; Forbes, W. C.
Synthetic magnesian merrihueite, dipotassium pentamagnesium dodecasilicate: a tetrahedral magnesiosilicate framework crystal structure
Acta Crystallographica, Section B, 1972, 28, 267-272
9011116 CIFSe8P 1 21/n 19.054; 9.083; 11.601
90; 90.81; 90		953.942Cherin, P.; Unger, P.
Refinement of the crystal structure of alpha-monoclinic Se Sample: at T = 26 C Note: structure known as alpha phase
Acta Crystallographica, Section B, 1972, 28, 313-317
9011117 CIFAg5 Hg7.55I 2 310.0506; 10.0506; 10.0506
90; 90; 90		1015.26Fairhurst, C. W.; Cohen, J. B.
The crystal structure of two compounds found in dental amalgam: Ag2Hg3 and Ag3Sn
Acta Crystallographica, Section B, 1972, 28, 371-378
9011118 CIFAg3 SnP m m n :25.968; 4.7802; 5.1843
90; 90; 90		147.899Fairhurst, C. W.; Cohen, J. B.
The crystal structure of two compounds found in dental amalgam: Ag2Hg3 and Ag3Sn
Acta Crystallographica, Section B, 1972, 28, 371-378
9011119 CIFC8 H5 N O2P 1 21/n 122.83; 7.651; 3.81
90; 91.36; 90		665.314Matzat, E.
Die kristallstruktur des phtalimids (kladnoit)
Acta Crystallographica, Section B, 1972, 28, 415-418
9011120 CIFGaC m c m10.593; 13.523; 5.203
90; 90; 90		745.325Bosio, L.; Curien, H.; Dupont, M.; Rimsky, A.
Structure cristalline de Ga-gamma Sample: at T = 220 K Note: structure known as gamma phase
Acta Crystallographica, Section B, 1972, 28, 1974-1975
9011121 CIFH9 N2 O4 PP 1 21/c 111.043; 6.7; 8.031
90; 113.42; 90		545.246Khan, A. A.; Roux, J. P.; James, W. J.
The crystal structure of diammonium hydrogen phosphate, (NH4)2HPO4
Acta Crystallographica, Section B, 1972, 28, 2065-2069
9011122 CIFH4 Mo O5P 1 21/n 110.476; 13.822; 10.606
90; 91.62; 90		1535.13Krebs, B.
Die kristallstruktur von MoO3*2H2O
Acta Crystallographica, Section B, 1972, 28, 2222-2231
9011123 CIFC2 H10 N2 O5P 21 21 28.035; 10.309; 3.795
90; 90; 90		314.351Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(XR)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011124 CIFC2 H10 N2 O5P 21 21 28.025; 10.3; 3.799
90; 90; 90		314.016Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(XR)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011125 CIFC2 H10 N2 O5P 21 21 28.027; 10.298; 3.816
90; 90; 90		315.438Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(XR)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011126 CIFC2 H10 N2 O5P 21 21 28.035; 10.309; 3.795
90; 90; 90		314.351Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(N)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011127 CIFC2 H2 N2 O5P 21 21 28.025; 10.3; 3.799
90; 90; 90		314.016Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(N)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011128 CIFC2 H10 N2 O5P 21 21 28.027; 10.298; 3.816
90; 90; 90		315.438Taylor, J. C.; Sabine, T. M.
Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(N)
Acta Crystallographica, Section B, 1972, 28, 3340-3351
9011129 CIFCl10 Cu4 K4 OC 1 2/c 114.7; 14.88; 8.95
90; 104.74; 90		1893.26de Boer, J. J.; Bright, D.; Helle, J. N.
The structure of the potassium salt of mu4-oxo-hexa-mu-chloro- tetra[chlorocuprate(II)], K4Cu4OCl10
Acta Crystallographica, Section B, 1972, 28, 3436-3437
9011130 CIFB5 H10 Na O13C 1 2/c 111.119; 16.474; 13.576
90; 112.83; 90		2291.96Merlino, S.; Sartori, F.
The crystal structure of sborgite, NaB5O6(OH)4*3H2O
Acta Crystallographica, Section B, 1972, 28, 3559-3567
9011131 CIFH0.886 O12.886 P3 Sr4.894P 63/m9.745; 9.745; 7.265
90; 90; 120		597.489Sudarsanan, K.; Young, R. A.
Structure of strontium hydroxide phosphate, Sr5(PO4)3OH Locality: synthetic
Acta Crystallographica, Section B, 1972, 28, 3668-3670
9011133 CIFCu3 S4 SbI -4 2 m5.385; 5.385; 10.754
90; 90; 90		311.847Garin, J.; Parthe, E.
The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4
Acta Crystallographica, Section B, 1972, 28, 3672-3674
9011134 CIFCu3 P Se4P m n 217.697; 6.661; 6.381
90; 90; 90		327.152Garin, J.; Parthe, E.
The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4
Acta Crystallographica, Section B, 1972, 28, 3672-3674
9011135 CIFAs Lu O4I 41/a m d :26.949; 6.949; 6.227
90; 90; 90		300.693Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C.
Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Note: isostructural with Chernovite-(Y)
Acta Crystallographica, Section B, 1973, 29, 141-142
9011136 CIFLu O4 PI 41/a m d :26.792; 6.792; 5.955
90; 90; 90		274.712Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C.
Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Note: isostructural with xenotime-(Y)
Acta Crystallographica, Section B, 1973, 29, 141-142
9011137 CIFO4 V YI 41/a m d :27.12; 7.12; 6.289
90; 90; 90		318.817Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C.
Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic
Acta Crystallographica, Section B, 1973, 29, 141-142
9011138 CIFCa O7 V3P n a m10.459; 5.295; 10.382
90; 90; 90		574.959Bouloux, J. C.; Galy, J.
Les hypovanadates MV3O7 (M=Ca,Sr,Cd). Structure cristalline de CaV3O7
Acta Crystallographica, Section B, 1973, 29, 269-275
9011139 CIFGaR -3 m :H9.087; 9.087; 17.02
90; 90; 120		1217.11Bosio, L.; Curien, H.; Dupont, M.; Rimsky, A.
Structure cristalline de Ga-delta Loclity: synthetic Sample: at T = 191 K Note: structure known as the delta phase
Acta Crystallographica, Section B, 1973, 29, 367-368
9011140 CIFCu O5 Te2P 1 21/c 16.871; 9.322; 7.602
90; 109.08; 90		460.169Hanke, K.; Kupcik, V.; Lindqvist, O.
The crystal structure of CuTe2O5
Acta Crystallographica, Section B, 1973, 29, 963-970
9011141 CIFO5 Te UP c a 2110.161; 5.363; 7.862
90; 90; 90		428.427Meunier, G.; Galy, J.
Structure cristalline de la schmitterite synthetique UTeO5
Acta Crystallographica, Section B, 1973, 29, 1251-1255
9011142 CIFCu5 O10 V2P 1 21/c 18.393; 6.0652; 16.156
90; 108.09; 90		781.772Shannon, R. D.; Calvo, C.
Crystal structure of Cu5V2O10
Acta Crystallographica, Section B, 1973, 29, 1338-1345
9011143 CIFAs Hg3 O4P 1 21/c 18.73; 5.08; 15.64
90; 128.4; 90		543.577Kamenar, B.; Kaitner, B.
The crystal structure of mercury(I) orthoarsenate
Acta Crystallographica, Section B, 1973, 29, 1666-1669
9011144 CIFCa4 O9 P2P 1 21 17.023; 11.986; 9.473
90; 90.9; 90		797.317Dickens, B.; Brown, W. E.; Kruger, G. J.; Stewart, J. M.
Ca4(PO4)2O, tetracalcium diphosphate monooxide. Crystal structure and relationships to Ca5(PO4)3OH and K3Na(SO4)2 Note: z(O11) corrected to match reported bond lengths
Acta Crystallographica, Section B, 1973, 29, 2046-2056
9011145 CIFCu9 Fe9 S16P -4 2 m10.585; 10.585; 5.383
90; 90; 90		603.123Hall, S. R.; Rowland, J. F.
The crystal structure of synthetic mooihoekite, Cu9Fe9S16
Acta Crystallographica, Section B, 1973, 29, 2365-2372
9011146 CIFNa O6 Sc Si2C 1 2/c 19.8438; 9.0439; 5.354
90; 107.215; 90		455.294Hawthorne, F. C.; Grundy, H. D.
Refinement of the crystal structure of NaScSi2O6
Acta Crystallographica, Section B, 1973, 29, 2615-2616
9011147 CIFH9 N Na O8 PP -110.636; 6.9187; 6.4359
90.46; 97.87; 109.2		442.331Ferraris, G.; Franchini-Angela M
Hydrogen bonding in the crystalline state. Crystal structure and twinning of NaNH4HPO4*4H2O (Stercorite)
Acta Crystallographica, Section B, 1974, 30, 504-510
9011148 CIFCl H4 Na O2P 1 21/c 16.3313; 10.1178; 6.5029
90; 114.407; 90		379.341Klewe, B.; Pedersen, B.
The crystal structure of sodium chloride dihydrate
Acta Crystallographica, Section B, 1974, 30, 2363-2371
9011149 CIFAl2.672 Ca0.82 H12 K O22 Si5.328P 1 21/m 19.865; 14.3; 8.668
90; 124.2; 90		1011.35Rinaldi, R.; Pluth, J. J.; Smith, J. V.
Zeolites of the phillipsite family. Refinement of the crystal structure of phillipsite and harmotome
Acta Crystallographica, Section B, 1974, 30, 2426-2433
9011150 CIFAl2.48 Ba Ca0.3 H12 O22 Si5.52P 1 21/m 19.879; 14.139; 8.693
90; 124.81; 90		996.944Rinaldi, R.; Pluth, J. J.; Smith, J. V.
Zeolites of the phillipsite family. Refinement of the crystal structure of phillipsite and harmotome
Acta Crystallographica, Section B, 1974, 30, 2426-2433
9011152 CIFH K O4 SP b c a8.412; 9.8; 18.957
90; 90; 90		1562.77Cotton, F. A.; Frenz, B. A.; Hunter, D. L.
The structure of potassium hydrogensulfate Note: y(O23), z(H1), x(H2) corrected
Acta Crystallographica, Section B, 1975, 31, 302-304
9011153 CIFC H2 Na2 O4P 21 a b6.472; 10.724; 5.259
90; 90; 90		365.005Wu, K. K.; Brown, I. D.
A neutron diffraction study of Na2CO3*H2O
Acta Crystallographica, Section B, 1975, 31, 890-892
9011154 CIFH8 O12 P2 Zn3P n m a10.629; 18.339; 5.04
90; 90; 90		982.423Whitaker, A.
The crystal structure of hopeite, Zn3(PO4)2*4H2O
Acta Crystallographica, Section B, 1975, 31, 2026-2035
9011155 CIFO9 S2 Sb2P 41 21 26.59; 6.59; 17.04
90; 90; 90		740.015Mercier, R.; Douglade, J.; Theobald, F. R.
Structure cristalline de Sb2O3*2SO3
Acta Crystallographica, Section B, 1975, 31, 2081-2085
9011156 CIFCu4 Fe5 S8P 2 2 210.705; 10.734; 31.63
90; 90; 90		3634.52Rowland, J. F.; Hall, S. R.
Haycockite, Cu4Fe5S8: a superstructure in the chalcopyrite series
Acta Crystallographica, Section B, 1975, 31, 2105-2112
9011157 CIFCu2.5 Fe0.5 S2P b c a10.95; 21.862; 10.95
90; 90; 90		2621.31Koto, K.; Morimoto, N.
Superstructure investigation of bornite, Cu5FeS4, by the modified partial Patterson function
Acta Crystallographica, Section B, 1975, 31, 2268-2273
9011158 CIFB5 H5 Na2 O11P n a 2112.015; 6.518; 11.173
90; 90; 90		875Corazza, E.; Menchetti, S.; Sabelli, C.
The crystal structure of nasinite, Na2[B5O8(OH)]*2H2O
Acta Crystallographica, Section B, 1975, 31, 2405-2410
9011159 CIFF3 LaP -3 c 17.185; 7.185; 7.351
90; 90; 120		328.648Cheetham, A. K.; Fender, B. E. F.; Fuess, H.; Wright, A. F.
A powder neutron diffraction study of lanthanum and cerium trifluorides Chem 5 (1966) 1466-1468
Acta Crystallographica, Section B, 1976, 32, 94-97
9011160 CIFCe F3P -3 c 17.131; 7.131; 7.286
90; 90; 120		320.864Cheetham, A. K.; Fender, B. E. F.; Fuess, H.; Wright, A. F.
A powder neutron diffraction study of lanthanum and cerium trifluorides
Acta Crystallographica, Section B, 1976, 32, 94-97
9011161 CIFCa9 H Mn O28 P7R 3 c :H10.438; 10.438; 37.15
90; 90; 120		3505.29Kostiner, E.; Rea, J. R.
The crystal structure of manganese-whitlockite, Ca18Mn2H2(PO4)14
Acta Crystallographica, Section B, 1976, 32, 250-253
9011162 CIFB7 Ba3 H4 Na O20 Si2C 1 2/c 114.639; 8.466; 13.438
90; 114.21; 90		1518.95Ghose, S.; Wan, C.; Ulbrich, H. H.
Structural chemistry of borosilicates. I. Garrelsite, NaBa3Si2B7O16(OH)4, a silicoborate with the pentaborate [B5O12]9- polyanion
Acta Crystallographica, Section B, 1976, 32, 824-832
9011163 CIFCu H12 N6 O6P n n m10.84; 23.693; 6.902
90; 90; 90		1772.66Morosin, B.
The crystal structure of copper(II) tetraammine nitrate
Acta Crystallographica, Section B, 1976, 32, 1237-1240
9011164 CIFFe6.34 Mn O38 Pb0.83 Ti13.66R -3 :R9.172; 9.172; 9.172
69.02; 69.02; 69.02		648.885Grey, I. E.; Lloyd, D. J.
The crystal structure of senaite
Acta Crystallographica, Section B, 1976, 32, 1509-1513
9011165 CIFO15 S2 Sb6C c c 212.073; 19.023; 5.876
90; 90; 90		1349.51Bovin, J. O.
The crystal structure of the antimony(III) oxide sulphate Sb6O7(SO4)2
Acta Crystallographica, Section B, 1976, 32, 1771-1777
9011166 CIFH K O4 SP b c a8.429; 9.807; 18.976
90; 90; 90		1568.62Payan, F.; Haser, R.
On the hydrogen bonding in potassium hydrogen sulphate. Comparison with a previous crystal structure determination
Acta Crystallographica, Section B, 1976, 32, 1875-1879
9011167 CIFO12 S3 Sb2P 1 21/c 113.12; 4.75; 17.55
90; 126.3; 90		881.457Mercier, R.; Douglade, J.; Bernard, J.
Structure cristalline de Sb2O3*3SO3
Acta Crystallographica, Section B, 1976, 32, 2787-2791
9011168 CIFH28 Mg3 N2 O24 P4P -110.728; 7.67; 6.702
97.87; 96.97; 104.74		521.225Catti, M.; Franchini-Angela M
Hydrogen bonding in the crystalline state. Structure of Mg3(NH4)2(HPO4)4*8H2O (hannayite), and crystal-chemical relationships with schertelite and struvite
Acta Crystallographica, Section B, 1976, 32, 2842-2848
9011169 CIFO2 SbP n a 215.456; 4.814; 11.787
90; 90; 90		309.588Thornton, G.
A neutron diffraction study of a-Sb2O4
Acta Crystallographica, Section B, 1977, 33, 1271-1273
9011170 CIFBR -3 m :H10.9251; 10.9251; 23.8143
90; 90; 120		2461.61Callmer, B.
An accurate refinement of the beta-rhombohedral boron structure
Acta Crystallographica, Section B, 1977, 33, 1951-1954
9011171 CIFAs Cu2 H O5P 21/n 1 18.615; 8.24; 5.953
90; 90; 90		422.589Toman, K.
The symmetry and crystal structure of olivenite Sample: alpha = .23
Acta Crystallographica, Section B, 1977, 33, 2628-2631
9011172 CIFAs Cu2 H O5P 21/n 1 18.615; 8.24; 5.953
90; 90; 90		422.589Toman, K.
The symmetry and crystal structure of olivenite Sample: alpha = .00
Acta Crystallographica, Section B, 1977, 33, 2628-2631
9011173 CIFCa Cl FP 4/n m m :23.894; 3.894; 6.818
90; 90; 90		103.383Liebich, W.; Nicollin, D.
Refinement of the PbFCl types BaFI, BaFBr and CaFCl Note: matlockite structure
Acta Crystallographica, Section B, 1977, 33, 2790-2794
9011174 CIFBa Br FP 4/n m m :24.508; 4.508; 7.441
90; 90; 90		151.216Liebich, W.; Nicollin, D.
Refinement of the PbFCl types BaFI, BaFBr and CaFCl Note: matlockite structure
Acta Crystallographica, Section B, 1977, 33, 2790-2794
9011175 CIFBa F IP 4/n m m :24.654; 4.654; 7.962
90; 90; 90		172.455Liebich, W.; Nicollin, D.
Refinement of the PbFCl types BaFI, BaFBr and CaFCl Note: matlockite structure
Acta Crystallographica, Section B, 1977, 33, 2790-2794
9011177 CIFAl1.42 Ba0.39 Ca0.01 K0.43 Na0.17 O8 Si2.58C 1 2/m 18.557; 13.04; 7.2
90; 115.69; 90		723.986De Pieri, R.; Quareni, S.; Hall, K. M.
Refinement of the structures of low and high hyalophanes Sample: Low hyalophane
Acta Crystallographica, Section B, 1977, 33, 3073-3076
9011178 CIFAl1.42 Ba0.39 Ca0.01 K0.43 Na0.17 O8 Si2.58C 1 2/m 18.556; 13.045; 7.189
90; 115.63; 90		723.436De Pieri, R.; Quareni, S.; Hall, K. M.
Refinement of the structures of low and high hyalophanes Sample: High hyalophane
Acta Crystallographica, Section B, 1977, 33, 3073-3076
9011179 CIFH5 Na2 O6 PP b c a16.872; 10.359; 6.599
90; 90; 90		1153.35Catti, M.; Ferraris, G.; Franchini-Angela M
The crystal structure of Na2HPO4*2H2O. Competition between coordination and hydrogen bonds Locality: synthetic Note: displacement parameters from ICSD, Biso(H1) invented
Acta Crystallographica, Section B, 1977, 33, 3449-3452
9011180 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120		237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 0-50 degree reflections Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011181 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120		237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 0-50 degree reflections, Al3+, O- Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011182 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120		237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 0-30 degree reflections Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011183 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120		237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 0-30 degree reflections, Al3+, O- Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011184 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120		237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 30-50 degree reflections Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011185 CIFAl B O3R -3 c :H4.4638; 4.4638; 13.745
90; 90; 120		237.184Vegas, A.; Cano, F. H.; Garcia-Blanco S
Refinement of aluminium orthoborate Sample: 30-50 degree reflections, Al3+, O- Note: calcite structure type
Acta Crystallographica, Section B, 1977, 33, 3607-3609
9011186 CIFCa I2 O6P 1 21/n 17.1432; 11.297; 7.2804
90; 106.35; 90		563.746Ghose, S.; Wan, C.
The crystal structure of synthetic lautarite, Ca(IO3)2 Note: Biso(O1) corrected
Acta Crystallographica, Section B, 1978, 34, 84-88
9011187 CIFFe Na O8 Ti3C 1 2/m 112.267; 3.823; 6.483
90; 107.16; 90		290.497Ishiguro, T.; Tanaka, K.; Marumo, F.; Ismail, M. G. M. U.; Hirano, S.; Somiya, S.
Freudenbergite Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1978, 34, 255-256
9011188 CIFAs Cu0.86 H O5 Zn1.14P n n m8.5; 8.52; 5.99
90; 90; 90		433.796Toman, K.
Ordering in olivenite-adamite solid solutions
Acta Crystallographica, Section B, 1978, 34, 715-721
9011189 CIFNa2 O5 Si TiP 4/n m m :16.48; 6.48; 5.107
90; 90; 90		214.445Nyman, H.; O'Keeffe M; Bovin, J. O.
Sodium titanium silicate, Na2TiSiO5 Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1978, 34, 905-906
9011190 CIFO3 Pb TiP 4 m m3.895; 3.895; 4.171
90; 90; 90		63.278Glazer, A. M.; Mabud, S. A.
Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample: T = -183 C
Acta Crystallographica, Section B, 1978, 34, 1065-1070
9011191 CIFO3 Pb TiP 4 m m3.899; 3.899; 4.167
90; 90; 90		63.348Glazer, A. M.; Mabud, S. A.
Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample; T = -115 C
Acta Crystallographica, Section B, 1978, 34, 1065-1070
9011192 CIFO3 Pb TiP 4 m m3.905; 3.905; 4.156
90; 90; 90		63.375Glazer, A. M.; Mabud, S. A.
Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample: T = 25 C
Acta Crystallographica, Section B, 1978, 34, 1065-1070
9011193 CIFO3 Pb TiP 4/m m m3.97; 3.97; 3.97
90; 90; 90		62.571Glazer, A. M.; Mabud, S. A.
Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample: T = 550 C
Acta Crystallographica, Section B, 1978, 34, 1065-1070
9011194 CIFO5 Te UP b c m5.363; 10.161; 7.862
90; 90; 90		428.427Loopstra, B. O.; Brandenburg, N. P.
Uranyl selenite and uranyl tellurite
Acta Crystallographica, Section B, 1978, 34, 1335-1337
9011195 CIFO5 Se UP 1 21/m 15.408; 9.278; 4.2545
90; 93.45; 90		213.084Loopstra, B. O.; Brandenburg, N. P.
Uranyl selenite and uranyl tellurite
Acta Crystallographica, Section B, 1978, 34, 1335-1337
9011196 CIFCa O10 S6 Sb10C 1 2/c 125.37; 5.654; 16.87
90; 117.58; 90		2144.89Nakai, I.; Nagashima, K.; Koto, K.; Morimoto, N.
Crystal structure of oxide-chalcogenide. I.The crystal stucture of sarabauite CaSb10O10S6 Locality: Sarabau mine, Sarawak, Malaysia
Acta Crystallographica, Section B, 1978, 34, 3569-3572
9011197 CIFMnP 41 3 26.315; 6.315; 6.315
90; 90; 90		251.837Shoemaker, C. B.; Shoemaker, D. P.; Hopkins, T. E.; Yindepit, S.
Refinement of the structure of beta-manganese and of related phase in the Mn-Ni-Si system
Acta Crystallographica, Section B, 1978, 34, 3573-3576
9011198 CIFMn3.28 Ni1.01 Si0.71P 21 36.292; 6.292; 6.292
90; 90; 90		249.096Shoemaker, C. B.; Shoemaker, D. P.; Hopkins, T. E.; Yindepit, S.
Refinement of the structure of beta-manganese and of related phase in the Mn-Ni-Si system
Acta Crystallographica, Section B, 1978, 34, 3573-3576
9011199 CIFH12 K Mg O10 PP m n 216.873; 6.16; 11.087
90; 90; 90		469.398Mathew, M.; Schroeder, L. W.
Crystal structure of a struvite analogue, MgKPO4*6H2O
Acta Crystallographica, Section B, 1979, 35, 11-13
9011200 CIFAl0.92 Ca0.43 Na0.07 O4 Si1.08I -18.183; 12.883; 14.186
93.38; 115.87; 90.82		1341.96Facchinelli, A.; Bruno, E.; Chiari, G.
The structure of bytownite quenched from 1723 K Locality: satellite dyke, Traversella stock, Sesia Lanzo zone, Western Alps, Italy Sample: non-split model Note: T and O anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 34-42
9011201 CIFAl7.76 Ca3.44 Na0.56 O32 Si8.24P -18.183; 12.883; 14.186
93.38; 115.87; 90.82		1341.96Facchinelli, A.; Bruno, E.; Chiari, G.
The structure of bytownite quenched from 1723 K Locality: satellite dyke, Traversella stock, Sesia Lanzo zone, Western Alps, Italy Sample: BytQ, P-1 model
Acta Crystallographica, Section B, 1979, 35, 34-42
9011202 CIFBi54 Pb46 S127P 1 21/m 1189.8; 4.09; 74.06
90; 11.93; 90		11884.4Matzat, E.
Cannizzarite Locality: Vulcano, Italy
Acta Crystallographica, Section B, 1979, 35, 133-136
9011203 CIFBi4 Te3R -3 m :H4.451; 4.451; 41.888
90; 90; 120		718.68Yamana, K.; Kihara, K.; Matsumoto, T.
Bismuth tellurides: BiTe and Bi4Te3 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 147-149
9011204 CIFBi TeP -3 m 14.423; 4.423; 24.002
90; 90; 120		406.642Yamana, K.; Kihara, K.; Matsumoto, T.
Bismuth tellurides: BiTe and Bi4Te3 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 147-149
9011205 CIFO5 Sb2C 1 2/c 112.646; 4.782; 5.4247
90; 103.91; 90		318.429Jansen, M.
Die kristallstruktur von antimon(V)-oxid
Acta Crystallographica, Section B, 1979, 35, 539-542
9011206 CIFH O5 Pb V ZnP n m a7.593; 6.057; 9.416
90; 90; 90		433.049Hawthorne, F. C.; Faggiani, R.
Refinement of the structure of descloizite Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 717-720
9011207 CIFH12 Mg N2 O12P 1 21/c 16.194; 12.707; 6.6
90; 92.99; 90		518.76Braibanti, A.; Tiripicchio, A.; Lanfredi, A. M. M.; Bigoli, F.
The crystal structures of nitrates of divalent hexaquocations. II. Hexaquomagnesium nitrate Note: z(Wat2) corrected
Acta Crystallographica, Section B, 1979, 35, 354-361
9011208 CIFO21 S6 Sb2P -16.644; 12.39; 9.678
92.69; 82.29; 96.88		783.412Douglade, J.; Mercier, R.
Structure cristalline du disulfate d'antimoine(III) Sb2(S2O7)3
Acta Crystallographica, Section B, 1979, 35, 1062-1067
9011209 CIFH10 O10 S VP 1 21/c 16.976; 9.716; 12.902
90; 110.9; 90		816.945Tachez, M.; Theobald, F. R.; Watson, K. J.; Mercier, R.
Redetermination de la structure du sulfate de vanadyle pentahydrate VOSO4*5H2O Locality: synthetic Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1979, 35, 1545-1550
9011210 CIFAl2 O30 P2 U3P 1 21/a 113.836; 20.918; 9.428
90; 112.44; 90		2522.05Piret, P.; Piret-Meunier J; Declercq, J. P.
Structure of phuralumite
Acta Crystallographica, Section B, 1979, 35, 1880-1882
9011211 CIFCu Fe0.5 S4 Sn1.5I 41/a :17.305; 7.305; 10.33
90; 90; 90		551.24Jumas, J. C.; Philippot, E.; Maurin, M.
Structure du rhodostannite synthetique
Acta Crystallographica, Section B, 1979, 35, 2195-2197
9011213 CIFBi2 Hg S4C 1 2/m 114.17; 4.06; 13.99
90; 118.27; 90		708.85Mumme, W. G.; Watts, J. A.
HgBi2S4: Crystal structure and relationship with the pavonite homologous series Locality: synthetic
Acta Crystallographica, Section B, 1980, 36, 1300-1304
9011214 CIFAs O4 SbP 1 21/m 14.794; 6.925; 5.307
90; 93.55; 90		175.846Jones, P. G.; Sheldrick, G. M.; Schwarzmann, E.
Antimony(III) arsenic(V) oxide
Acta Crystallographica, Section B, 1980, 36, 1923-1925
9011215 CIFC4 H4 Cu Na2 O10P -13.583; 9.649; 7.549
109.07; 76.38; 103.32		236.358Chananont, P.; Nixon, P. E.; Waters, J. M.; Water, T. N.
The structure of disodium catena-bis(mu-oxalato)-cuprate(II) dihydrate
Acta Crystallographica, Section B, 1980, 36, 2145-2147
9011216 CIFO2 PbP 42/m n m4.9578; 4.9578; 3.3878
90; 90; 90		83.271D'Antonio P; Santoro, A.
Powder neutron diffraction study of chemically prepared B-lead dioxide
Acta Crystallographica, Section B, 1980, 36, 2394-2397
9011217 CIFO SnP 4/n m m :13.8029; 3.8029; 4.8382
90; 90; 90		69.97Pannetier, J.; Denes, G.
Tin(II) oxide: structure refinement and thermal expansion
Acta Crystallographica, Section B, 1980, 36, 2763-2765
9011218 CIFN2P m -3 n6.164; 6.164; 6.164
90; 90; 90		234.201Cromer, D. T.; Mills, R. L.; Schiferl, D.; Schwalbe, L. A.
The structure of N2 at 49 kbar and 299 K Sample: at T = 299 K and P = 4.9 GPa Note: model #4
Acta Crystallographica, Section B, 1981, 37, 8-11
9011219 CIFBr1.012 Ca4.922 O11.965 P2.896P 63/m9.761; 9.761; 6.739
90; 90; 120		556.051Elliott, J. C.; Dykes, E.; Mackie, P. E.
Structure of bromapatite and the radius of the bromide ion
Acta Crystallographica, Section B, 1981, 37, 435-438
9011220 CIFCa11 O18 S Si4I -4 m 210.461; 10.461; 8.813
90; 90; 90		964.429Dent Glasser, L. S.; Lee, C. K.
The structure of jasmundite, Ca22(SiO4)8O4S2 Locality: Ettringer Feld lava flow, Bellerberg volcano, Mayen, Eifel, Germany
Acta Crystallographica, Section B, 1981, 37, 803-806
9011221 CIFC2 Na2 O4P 1 21/c 13.449; 5.243; 10.375
90; 92.66; 90		187.41Reed, D. A.; Olmstead, M. M.
Sodium oxalate structure refinement Sample: T = 140 K
Acta Crystallographica, Section B, 1981, 37, 938-939
9011222 CIFCa O3 SiC -16.853; 11.895; 19.674
90.12; 90.55; 90		1603.68Yamanaka, T.; Mori, H.
The structure and polytypes of alpha-W CaSiO3 (pseudowollastonite)
Acta Crystallographica, Section B, 1981, 37, 1010-1017
9011223 CIFAs3 Fe3 H24 O26 Zn2C 1 m 111.415; 11.259; 8.661
90; 107.74; 90		1060.19Ginderow, D.; Cesbron, F.
Structure de la mapimite, Zn2Fe3(AsO4)3(OH)4*10H2O Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1981, 37, 1040-1043
9011224 CIFC2 H10 Mg0.773 Mn3.684 O16 Zn2.543A 1 2/a 116.408; 5.54; 15.15
90; 95.48; 90		1370.85Hill, R. J.
The structure of loseyite Note: AnisoU's from ICSD
Acta Crystallographica, Section B, 1981, 37, 1323-1328
9011225 CIFAs3 Fe H10 O17P 1 21/n 115.25; 19.6; 4.72
90; 91.8; 90		1410.11Boudjada, A.; Guitel, J. C.
Structure cristalline d'un orthoarseniate acide de fer(III) pentahydrate: Fe(H2AsO4)3*5H2O Locality: synthetic Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1981, 37, 1402-1405
9011226 CIFAs0.185 Ca0.192 Fe0.348 H Mn5.772 O19 Si5 V0.815P 1 21/n 16.712; 28.948; 7.578
90; 95.4; 90		1465.86Gramaccioli, C. M.; Liborio, G.; Pilati, T.
Structure of medaite, Mn6[VSi5O18(OH)]: The presence of a new kind of heteropolysilicate anion Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1981, 37, 1972-1978
9011227 CIFB Cl H4 Na2 O4P 4/n m m :27.26; 7.26; 4.847
90; 90; 90		255.474Effenberger, H.
Verfeinerung der kristallstruktur von synthetischem teepleit
Acta Crystallographica, Section B, 1982, 38, 82-85
9011228 CIFAl13 Cl F4 H14 O34 Si5F -4 3 m13.8654; 13.8654; 13.8654
90; 90; 90		2665.61Baur, W. H.; Ohta, T.
The Si5O16 pentamer in zunyite refined and empirical relations for individual silicon-oxygen bonds Locality: Quartzsite, Arizona, USA
Acta Crystallographica, Section B, 1982, 38, 390-401
9011229 CIFAl13.25 Cl F4 H14 O34 Si4.75F -4 3 m13.8796; 13.8796; 13.8796
90; 90; 90		2673.81Baur, W. H.; Ohta, T.
The Si5O16 pentamer in zunyite refined and empirical relations for individual silicon-oxygen bonds Locality: Zuni Mine, Colorado, USA Sample: M9003
Acta Crystallographica, Section B, 1982, 38, 390-401
9011230 CIFAs2 O12 S3P 1 21/c 19.389; 5.255; 19.355
90; 91.88; 90		954.446Douglade, J.; Mercier, R.
Structure cristalline et covalence des liaisons dans le sulfate d'arsenic(III), As2(SO4)3 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1982, 38, 720-723
9011231 CIFAs2 O6 SP 21 21 24.628; 11.497; 4.776
90; 90; 90		254.122Mercier, R.; Douglade, J.
Affinement de la structure avec tunnels de paires E dans un oxysulfate d'arsenic: (As2O2)(SO4)
Acta Crystallographica, Section B, 1982, 38, 896-898
9011232 CIFC4 H16 Co N4 Na2 O8 S4P 1 21/n 118.941; 19.209; 5.46
90; 91.64; 90		1985.74Mereiter, K.; Preisinger, A.
The structure of sodium tetraisothiocyanatocobaltate(II) octahydrate Na2[Co(NCS)4]*8H2O Locality: synthetic
Acta Crystallographica, Section B, 1982, 38, 1084-1088
9011233 CIFCu3 O8 V2P -15.196; 5.355; 6.505
69.22; 88.69; 68.08		155.733Coing-Boyat J
Structure de la variete ordinaire, triclinique, de l'orthovanadate de cuivre(II), Cu3(VO4)2
Acta Crystallographica, Section B, 1982, 38, 1546-1548
9011234 CIFAs Bi O4P 1 21/n 16.879; 7.159; 6.732
90; 104.84; 90		320.471Bedlivy, D.; Mereiter, K.
Structure of alpha-BiAsO4 (rooseveltite) Note: AnisoU's from ICSD
Acta Crystallographica, Section B, 1982, 38, 1559-1561
9011235 CIFAs2 O9 S2P 1 c 16.65; 6.671; 16.612
90; 94.34; 90		734.831Mercier, R.; Douglade, J.
Structure cristalline d'un oxysulfate d'arsenic(III) As2O(SO4)2 (ou As2O3*(SO3)2) Note: AnisoB's from ICSD
Acta Crystallographica, Section B, 1982, 38, 1731-1735
9011236 CIFS3 Sn2P n m a8.878; 3.751; 14.02
90; 90; 90		466.885Kniep, R.; Mootz, D.; Severin, U.; Wunderlich, H.
Structure of tin(II) tin(IV) trisulphide, a redetermination
Acta Crystallographica, Section B, 1982, 38, 2022-2023
9011237 CIFBi H3 O6 SP 1 21/n 16.021; 13.363; 6.495
90; 112.94; 90		481.25Graunar, M.; Lazarini, F.
Di-mu-hydroxo-bis[aquasulfatobismuth(III)] Locality: synthetic
Acta Crystallographica, Section B, 1982, 38, 2879-2881
9011238 CIFBi2 H2 O7 SP 1 21/c 17.692; 13.87; 5.688
90; 109.01; 90		573.745Golic, L.; Graunar, M.; Lazarini, F.
catena-Di-mu-hydroxo-mu3-oxo-dibismuth(III) sulfate
Acta Crystallographica, Section B, 1982, 38, 2881-2883
9011239 CIFAs2 Ca3 H22 O19P -112.563; 12.181; 6.205
88.94; 91.67; 113.44		870.796Catti, M.; Ivaldi, G.
On the topotactic dehydration Ca3(AsO4)2*11H2O (phaunouxite) -> Ca3(AsO4)2*10H2O (rauenthalite), and the structures of both minerals
Acta Crystallographica, Section B, 1983, 39, 4-10
9011240 CIFAs2 Ca3 H20 O18P -112.564; 12.169; 6.195
89.09; 79.69; 118.58		812.654Catti, M.; Ivaldi, G.
On the topotactic dehydration Ca3(AsO4)2*11H2O (phaunouxite) -> Ca3(AsO4)2*10H2O (rauenthalite), and the structures of both minerals
Acta Crystallographica, Section B, 1983, 39, 4-10
9011241 CIFNa O3 VP n m a14.147; 3.6496; 5.364
90; 90; 90		276.948Kato, K.; Takayama, E.
Das entwaesserungsverhalten des natriummetavanadatdihydrats und die kristallstruktur des beta-natriummetavanadats Note: anisoB's corrected from ICSD
Acta Crystallographica, Section B, 1984, 40, 102-105
9011242 CIFC2 Cu Na2 O6P 1 21/a 16.17; 8.171; 5.648
90; 116.24; 90		255.401Maslen, E. N.; Spadaccini, N.; Watson, K. J.
Electron density in non-ideal metal complexes. II. Sodium bis(carbonato)cuprate(II)
Acta Crystallographica, Section B, 1986, 42, 430-436
9011243 CIFH12 Ni O10 SP 41 21 26.783; 6.783; 18.288
90; 90; 90		841.414Stadnicka, K.; Glazer, A. M.; Koralewski, M.
Structure, absolute configuration and optical activity of alpha-nickel sulfate hexahydrate Locality: synthetic Note: y(O3) corrected to match reported bond lengths
Acta Crystallographica, Section B, 1987, 43, 319-325
9011244 CIFC10 H22 O3F d d 218.421; 22.791; 10.912
90; 90; 90		4581.22Marsh, E. R.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011245 CIFC3 NF d d 213.635; 26.353; 6.089
89.87; 90; 90		2187.91Marsh, R. E.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011246 CIFC7 H10 S2F d d 211.419; 41.077; 6.626
90; 90; 90		3107.98Marsh, R. E.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011247 CIFC11 H8 Ce N18 O19C 1 2/c 116.05; 13.14; 16.631
90; 108.1; 90		3333.86Marsh, R. E.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011248 CIFC19 H9P 1 21/a 131.276; 3.7818; 21.663
90; 124.22; 90		2118.72Marsh, R. E.; Herbstein, F. H.
More space group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011249 CIFAs2 O9 S2P 1 21/c 16.65; 6.671; 16.612
90; 94.34; 90		734.831Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011250 CIFF7 Ho2 KC 1 2/m 114.287; 8.004; 11.95
90; 125.33; 90		1114.85Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011251 CIFC16 N OC 1 2/c 124.28; 8.76; 14.03
90; 108; 90		2838.03Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011252 CIFAs3 Cd2 IC 1 2/c 18.436; 9.594; 7.952
90; 100.65; 90		632.509Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011253 CIFC2 Br2 O TlC m c m10.31; 8.56; 15.55
90; 90; 90		1372.34Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011254 CIFC12 Cl3 Cr2 F2 N8 O14P -110.71; 9.047; 8.785
111.25; 100.44; 86.6		780.18Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011255 CIFC6 I SP n a m18.038; 6.611; 7.42
90; 90; 90		884.829Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011256 CIFC24 H2 N2 O5C 1 2/c 118.943; 11.318; 24.376
90; 94.5; 90		5210.03Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011257 CIFEr2 F7 KP n a m11.82; 13.333; 7.816
90; 90; 90		1231.77Marsh, R. E.; Herbstein, F. H.
More space-group changes
Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88
9011258 CIFAg0.1 Au0.9 Te2C 1 2/m 17.1947; 4.4146; 5.0703
90; 90.038; 90		161.041Schutte, W. J.; de Boer, J. L.
Valence fluctuations in the incommensurately modulated structure of calaverite AuTe2 Locality: Cripple Creek, Colorado Sample: T = 298 K
Acta Crystallographica, Section B, 1988, 44, 486-494
9011259 CIFAg0.1 Au0.9 Te2C 1 2/m 17.182; 4.402; 5.056
90; 89.99; 90		159.846Schutte, W. J.; de Boer, J. L.
Valence fluctuations in the incommensurately modulated structure of calaverite AuTe2 Locality: Cripple Creek, Colorado Sample: T = 100 K
Acta Crystallographica, Section B, 1988, 44, 486-494
9011260 CIFMg2 O4 TiP 41 2 25.9748; 5.9748; 8.414
90; 90; 90		300.365Wechsler, B. A.; Von Dreele, R. B.
Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 773 K
Acta Crystallographica, Section B, 1989, 45, 542-549
9011261 CIFMg O3 TiR -3 :H5.05478; 5.05478; 13.8992
90; 90; 120		307.557Wechsler, B. A.; Von Dreele, R. B.
Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic
Acta Crystallographica, Section B, 1989, 45, 542-549
9011262 CIFMg0.999 O5 Ti2.001B b m m9.7289; 10.0057; 3.7416
90; 90; 90		364.224Wechsler, B. A.; Von Dreele, R. B.
Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 973 K
Acta Crystallographica, Section B, 1989, 45, 542-549
9011263 CIFMg O5 Ti2B b m m9.7492; 9.9896; 3.746
90; 90; 90		364.825Wechsler, B. A.; Von Dreele, R. B.
Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 1773
Acta Crystallographica, Section B, 1989, 45, 542-549
9011264 CIFD12 Ni O10 SP 43 21 26.7803; 6.7803; 18.288
90; 90; 90		840.744McIntyre, G. J.; Ptasiewicz-Bak H; Olovsson, I.
Bonding deformation and superposition effects in the electron density of tetragonal nickel sulfate hexadeuterate NiSO4*6D2O Sample: neutron refinement Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1990, 46, 27-39
9011265 CIFH12 Ni O10 SP 43 21 26.7803; 6.7803; 18.288
90; 90; 90		840.744McIntyre, G. J.; Ptasiewicz-Bak H; Olovsson, I.
Bonding deformation and superposition effects in the electron density of tetragonal nickel sulfate hexadeuterate NiSO4*6D2O Sample: X-ray refinement
Acta Crystallographica, Section B, 1990, 46, 27-39
9011266 CIFCa4 H120 Na3 O252 Si85P n m a20.078; 19.894; 13.372
90; 90; 90		5341.2van Koningsveld, H.
High-temperature (350 K) orthorhombic framework structure of zeolite H-ZSM-5 Note: anisotropic thermal parameters obtained from ICSD
Acta Crystallographica, Section B, 1990, 46, 731-735
9011267 CIFC14 H10P 1 21 18.441; 6.14; 9.438
90; 97.96; 90		484.437Petricek, V.; Cisarova, I.; Hummel, L.; Kroupa, J.; Brezina, B.
Oriental disorder in phenanthrene. Structure determination at 248, 295, 339 and 344 K Locality: synthetic
Acta Crystallographica, Section B, 1990, 46, 830-832
9011268 CIFBi12.5 Fe0.5 O19.48I 2 310.184; 10.184; 10.184
90; 90; 90		1056.22Radaev, S. F.; Muradyan, L. A.; Simonov, V. I.
Atomic structure and crystal chemistry of sillenites: Bi12(Bi3+0.50Fe3+0.50)O19.50 and Bi12(Bi3+0.50Fe3+0.50)O19.33 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1991, 47, 1-6
9011269 CIFBi12.672 O19.32 Zn0.33I 2 310.207; 10.207; 10.207
90; 90; 90		1063.39Radaev, S. F.; Muradyan, L. A.; Simonov, V. I.
Atomic structure and crystal chemistry of sillenites: Bi12(Bi3+0.50Fe3+0.50)O19.50 and Bi12(Bi3+0.50Fe3+0.50)O19.33 Note: anisoB's from ICSD Note: z(Bi) corrected
Acta Crystallographica, Section B, 1991, 47, 1-6
9011270 CIFAl11 Na1.221 O17.111P 63/m m c5.5929; 5.5929; 22.526
90; 90; 120		610.223Edstrom, K.; Thomas, J. O.; Farrington, G. C.
Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Locality: synthetic Sample: y = 0 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1991, 47, 635-643
9011271 CIFAl11 Cd0.105 Na1.008 O17.111P 63/m m c5.5921; 5.5921; 22.526
90; 90; 120		610.049Edstrom, K.; Thomas, J. O.; Farrington, G. C.
Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Locality: synthetic Sample: y = .21 Note: anisoB's from ICSD
Acta Crystallographica, Section B, 1991, 47, 635-643
9011272 CIFAl11 Cd0.222 Na0.774 O17.111P 63/m m c5.5906; 5.5906; 22.519
90; 90; 120		609.532Edstrom, K.; Thomas, J. O.; Farrington, G. C.
Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Locality: synthetic Note: anisoB's from ICSD Sample: y = .45
Acta Crystallographica, Section B, 1991, 47, 635-643
9011273 CIFAl11 Cd0.615 O17.111P 63/m m c5.5869; 5.5869; 22.37
90; 90; 120		604.698Edstrom, K.; Thomas, J. O.; Farrington, G. C.
Structural aspects of the Na+ -> Cd2+ ion-exchange process in Na+ beta-alumina Note: anisoB's from ICSD Sample: y = 1.22
Acta Crystallographica, Section B, 1991, 47, 635-643
9011274 CIFK O5 P TiP n a 2112.8209; 6.4052; 10.5932
90; 90; 90		869.918Hansen, N. K.; Protas, J.; Marnier, G.
The electron-density distribution in KTiOPO4
Acta Crystallographica, Section B, 1991, 47, 660-672
9011275 CIFAg Cu SC m c 214.059; 6.617; 7.967
90; 90; 90		213.981Baker, C. L.; Lincoln, F. J.; Johnson, A. W. S.
A low-temperature structural phase transformation in CuAgS Sample: T = 298 K
Acta Crystallographica, Section B, 1991, 47, 891-899
9011276 CIFAg Cu SP m c 214.047; 6.592; 7.93
90; 90; 90		211.555Baker, C. L.; Lincoln, F. J.; Johnson, A. W. S.
A low-temperature structural phase transformation in CuAgS Sample: T = 120 K Note: dimorphic with stromeyerite
Acta Crystallographica, Section B, 1991, 47, 891-899
9011277 CIFAg Cu SP m c 214.0431; 6.591; 7.9149
90; 90; 90		210.917Baker, C. L.; Lincoln, F. J.; Johnson, A. W. S.
A low-temperature structural phase transformation in CuAgS Sample: T = 13 K Note: dimorphic with stromeyerite
Acta Crystallographica, Section B, 1991, 47, 891-899
9011278 CIFAu Te2C 1 2/m 17.189; 4.407; 5.069
90; 89.96; 90		160.596Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 0.0001 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011279 CIFAu Te2C 1 2/m 17.189; 4.407; 5.069
90; 89.96; 90		160.596Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = <0.5 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011280 CIFAu Te2C 1 2/m 17.171; 4.385; 5.064
90; 90.04; 90		159.237Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 0.41 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011281 CIFAu Te2C 1 2/m 17.164; 4.371; 5.064
90; 90; 90		158.573Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 0.63 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011282 CIFAu Te2C 1 2/m 17.129; 4.314; 5.036
90; 90.15; 90		154.879Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 1.63 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011283 CIFAu Te2C 1 2/m 17.11; 4.29; 5.05
90; 90.3; 90		154.032Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 1.78 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011284 CIFAu Te2C 1 2/m 17.1; 4.286; 5.029
90; 90.3; 90		153.033Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 1.89 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011285 CIFAu Te2C 1 2/m 17.1; 4.221; 5.029
90; 90.4; 90		150.711Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 2.40 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011286 CIFAu Te2P -3 m 14.1; 4.1; 5.021
90; 90; 120		73.095Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 3.72 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011287 CIFAu Te2P -3 m 14.078; 4.078; 5
90; 90; 120		72.01Reithmayer, K.; Steurer, W.; Schulz, H.; de Boer, J. L.
High-pressure single-crystal structure study on calaverite, AuTe2 Sample: P = 5.13 GPa
Acta Crystallographica, Section B, 1993, 49, 6-11
9011288 CIFH12 Ni O10 SP 43 21 26.7778; 6.7778; 18.176
90; 90; 90		834.979Ptasiewicz-Bak H; Olovsson, I.; McIntyre, G. J.
Bonding deformation and superposition in the electron density of tetragonal NiSO4*6H2O at 25K Sample: T = 25 K, neutron refinement Note: anisoU's from ICSD
Acta Crystallographica, Section B, 1993, 49, 192-201
9011289 CIFNi O10 SP 43 21 26.7778; 6.7778; 18.176
90; 90; 90		834.979Ptasiewicz-Bak H; Olovsson, I.; McIntyre, G. J.
Bonding deformation and superposition in the electron density of tetragonal NiSO4*6H2O at 25K Sample: T = 25 K, X-ray refinement
Acta Crystallographica, Section B, 1993, 49, 192-201
9011290 CIFF6 K2 SiF m -3 m8.1419; 8.1419; 8.1419
90; 90; 90		539.731Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y.
Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Sample: .9 angstroms
Acta Crystallographica, Section B, 1993, 49, 967-973
9011291 CIFF6 K2 SiF m -3 m8.1419; 8.1419; 8.1419
90; 90; 90		539.731Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y.
Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Sample: .7 angstroms
Acta Crystallographica, Section B, 1993, 49, 967-973
9011292 CIFF6 K2 SiF m -3 m8.1419; 8.1419; 8.1419
90; 90; 90		539.731Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y.
Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6 Sample: Mo K-alpha
Acta Crystallographica, Section B, 1993, 49, 967-973
9011293 CIFCl6 K2 PdF m -3 m8.1419; 8.1419; 8.1419
90; 90; 90		539.731Hester, J. R.; Maslen, E. N.; Spadaccini, N.; Ishizawa, N.; Satow, Y.
Accurate synchrotron radiation delta rho maps for K2SiF6 and K2PdCl6
Acta Crystallographica, Section B, 1993, 49, 967-973
9011296 CIFFe4 H2 K2 Mg2 Na2 O15 Si4 TiP 110.37; 23.129; 5.322
90; 99.55; 90		1258.78Shi, N.; Ma, Z.; Li, G.; Yamnova, M. A.; Pushcharovsky, D. Y.
Structure refinement of monoclinic astrophyllite Locality: Khibina alkaline massif, Russia
Acta Crystallographica, Section B, 1998, 54, 109-114
9011298 CIFH34 O40 U8P b c n14.6861; 13.9799; 16.7063
90; 90; 90		3429.97Weller, M. T.; Light, M. E.; Gelbrich, T.
Structure of uranium (VI) oxide dihydrate UO3*2H2O; synthetic meta-schoepite (UO2)4O(OH)6*5H2O Sample: T = 150 K
Acta Crystallographica, Section B, 2000, 56, 577-583
9011299 CIFAl3 H21.52 N2.38 Na0.26 O20.64 Si5P 1 21/m 110.0507; 14.2016; 8.7281
90; 125.123; 90		1018.97Gualtieri, A. F.
Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 1
Acta Crystallographica, Section B, 2000, 56, 584-593
9011300 CIFAl2.2 H20.08 N2.02 Na0.2 O20.74 Si5.8P 1 21/m 110.0122; 14.1943; 8.7284
90; 125.024; 90		1015.82Gualtieri, A. F.
Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 2
Acta Crystallographica, Section B, 2000, 56, 584-593
9011301 CIFAl1.9 H18.8 N1.7 Na0.2 O21.18 Si6.1P 1 21/m 19.9596; 14.2015; 8.7051
90; 124.99; 90		1008.71Gualtieri, A. F.
Study of NH4+ in the zeolite phillipsite by combined synchrotron powder diffraction and IR spectroscopy Sample: 3
Acta Crystallographica, Section B, 2000, 56, 584-593
9011304 CIFC Na2 O3C 1 2/m 18.92; 5.245; 6.05
90; 101.35; 90		277.516Dusek, M.; Chapuis, G.; Meyer, M.; Petricek, V.
Sodium carbonate revisited Sample: Gamma phase, T = 295 K
Acta Crystallographica, Section B, 2003, 59, 337-352
9011305 CIFC Na2 O3C 1 2/m 18.898; 5.237; 5.996
90; 101.87; 90		273.432Dusek, M.; Chapuis, G.; Meyer, M.; Petricek, V.
Sodium carbonate revisited Sample: Delta phase, T = 110 K
Acta Crystallographica, Section B, 2003, 59, 337-352
9011308 CIFAg12.226 As1.192 Cu3.772 S11 Sb0.808P -3 m 17.389; 7.389; 11.816
90; 90; 120		558.692Bindi, L.; Evain, M.; Menchetti, S.
Temperature dependence of the silver distribution in the crystal structure of natural pearcite, (Ag,Cu)16(As,Sb)2S11 Sample: T = 15 K
Acta Crystallographica, Section B, 2006, 62, 212-219
9011309 CIFAg13.646 As1.179 Cu2.966 S11 Sb0.821P -3 m 17.3721; 7.3721; 11.8104
90; 90; 120		555.876Bindi, L.; Evain, M.; Menchetti, S.
Temperature dependence of the silver distribution in the crystal structure of natural pearcite, (Ag,Cu)16(As,Sb)2S11 Sample: T = 120 K
Acta Crystallographica, Section B, 2006, 62, 212-219
9011310 CIFAg13.032 As1.18 Cu2.968 S11 Sb0.82P -3 m 17.3876; 7.3876; 11.8882
90; 90; 120		561.893Bindi, L.; Evain, M.; Menchetti, S.
Temperature dependence of the silver distribution in the crystal structure of natural pearcite, (Ag,Cu)16(As,Sb)2S11 Sample: T = 300 K
Acta Crystallographica, Section B, 2006, 62, 212-219
9011311 CIFNa O3.5 Si1.5C 1 2/c 120.416; 6.4987; 4.9294
90; 90.26; 90		654.014Kruger, H.; Kahlenberg, V.; Friese, K.
Na2Si3O7: an incommensurate structure with crenel-type modulation functions, refined from a twinned crystal
Acta Crystallographica, Section B, 2006, 62, 440-446
9011312 CIFAg29.629 Cu2.371 S22 Sb4C 1 2/c 126.188; 15.1199; 23.784
90; 90; 90		9417.51Evain, M.; Bindi, L.; Menchetti, S.
Structural compexity in minerals: twinning, polytypism and disorder in the crystal structure of polybasite, (Ag,Cu)16(Sb,As)2S11 Sample: T = 100 K Sample: polytype 222
Acta Crystallographica, Section B, 2006, 62, 447-456
9011313 CIFAg29.04 Cu2.96 S22 Sb4P 3 2 115.0954; 15.0954; 11.8825
90; 90; 120		2344.92Evain, M.; Bindi, L.; Menchetti, S.
Structural compexity in minerals: twinning, polytypism and disorder in the crystal structure of polybasite, (Ag,Cu)16(Sb,As)2S11 Sample: T = 120 K Sample: polytype 221
Acta Crystallographica, Section B, 2006, 62, 447-456
9011314 CIFH2 Ni O2P -3 m 13.12; 3.12; 4.61
90; 90; 120		38.863Ramesh, T. N.; Kamath, P. V.; Shivakumara, C.
Classification of stacking faults and their stepwise elemination during the disorder -> order transformation of nickel hydroxide
Acta Crystallographica, Section B, 2006, 62, 530-536
9011315 CIFCa2 Co0.9 O7 Si2 Zn0.1P -423.518; 23.518; 5.0263
90; 90; 90		2780.03Jia, Z. H.; Schaper, A. K.; Massa, W.; Treutmann, W.; Rager, H.
Structure and phase transitions in Ca2CoSi2O7-Ca2ZnSi2O7 solid-solution crystals
Acta Crystallographica, Section B, 2006, 62, 547-555
9011317 CIF
Paper		Ag16.08 As0.34 Cu1.84 S8.34 Sb1.66 Se2.66P -3 m 17.595; 7.595; 12.0731
90; 90; 120		603.122Evain, M.; Bindi, L.; Menchetti, S.
Structure and phase transition of the Se-rich variety of antimonpearceite, [(Ag,Cu)~6~(Sb,As)~2~(S,Se)~7~][Ag~9~Cu(S,Se)~2~Se~2~]
Acta Crystallographica Section B, 2006, 62, 768-774
9011318 CIF
Paper		Ag14.691 Cu1.309 S8.37 Sb2 Se2.63P 1 21/c 113.1426; 7.5879; 23.729
90; 90; 90		2366.37Evain, M.; Bindi, L.; Menchetti, S.
Structure and phase transition of the Se-rich variety of antimonpearceite, [(Ag,Cu)~6~(Sb,As)~2~(S,Se)~7~][Ag~9~Cu(S,Se)~2~Se~2~]
Acta Crystallographica Section B, 2006, 62, 768-774
9011319 CIFCu0.298 Pb0.95 S3.36 Sb0.408 Sn0.851C -13.6661; 6.3138; 11.9028
92.49; 90.59; 89.986		275.24Evain, M.; Petricek, V.; Moelo, Y.; Maurel, C.
First (3+2)-dimensional superspace approach to the structure of levyclaudite-(Sb), a member of the cylindrite-type minerals
Acta Crystallographica, Section B, 2006, 62, 775-789
9011321 CIFCl2 Cu3 H6 Mg O6P -3 m 16.2733; 6.2733; 5.7472
90; 90; 120		195.875Malcherek, T.; Schluter, J.
Cu3MgCl2(OH)6 and the bond-valence parameters of the OH-Cl bond
Acta Crystallographica, Section B, 2007, 63, 157-160
9011322 CIFCl H6 Mg0.5 O2C m c m4.21616; 11.023; 7.2951
90; 90; 90		339.038Sugimoto, K.; Dinnebier, R. E.; Hanson, J. C.
Structures of three dehydration products of bischofite from in situ synchrotron powder diffraction data (MgCl2*nH2O; n = 1,2,4)
Acta Crystallographica, Section B, 2007, 63, 235-242
9011327 CIFK0.778 Mg0.388 O8 Ti3.612I 4/m10.1541; 10.1541; 2.9735
90; 90; 90		306.585Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 1
Acta Crystallographica, Section B, 2007, 63, 577-583
9011328 CIFK0.774 Mg0.384 O8 Ti3.616I 4/m10.1541; 10.1541; 2.9735
90; 90; 90		306.585Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 2
Acta Crystallographica, Section B, 2007, 63, 577-583
9011329 CIFK0.765 Mg0.383 O8 Ti3.617I 4/m10.1541; 10.1541; 2.9735
90; 90; 90		306.585Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 3
Acta Crystallographica, Section B, 2007, 63, 577-583
9011330 CIFK0.77 Mg0.385 O8 Ti3.615I 4/m10.1541; 10.1541; 2.9735
90; 90; 90		306.585Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 4
Acta Crystallographica, Section B, 2007, 63, 577-583
9011331 CIFMg0.377 O8 Rb0.754 Ti3.623I 4/m10.2052; 10.2052; 2.9717
90; 90; 90		309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 5
Acta Crystallographica, Section B, 2007, 63, 577-583
9011332 CIFMg0.377 O8 Rb0.754 Ti3.623I 4/m10.2052; 10.2052; 2.9717
90; 90; 90		309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 6
Acta Crystallographica, Section B, 2007, 63, 577-583
9011333 CIFMg0.375 O8 Rb0.751 Ti3.625I 4/m10.2052; 10.2052; 2.9717
90; 90; 90		309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 7
Acta Crystallographica, Section B, 2007, 63, 577-583
9011334 CIFMg0.376 O8 Rb0.751 Ti3.624I 4/m10.2052; 10.2052; 2.9717
90; 90; 90		309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 8
Acta Crystallographica, Section B, 2007, 63, 577-583
9011335 CIFMg0.378 O8 Rb0.756 Ti3.622I 4/m10.2052; 10.2052; 2.9717
90; 90; 90		309.491Michiue, Y.
Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 9
Acta Crystallographica, Section B, 2007, 63, 577-583
9011338 CIFAl7 Ca6 O16.348I -4 3 d12.0449; 12.0449; 12.0449
90; 90; 90		1747.47Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.
Structure and oxygen mobility in mayenite (Ca12Al14O33): a high-temperature neutron powder diffraction study Sample: T = 1223 K
Acta Crystallographica, Section B, 2007, 63, 675-682
9011379 CIFCl5 Fe H2 K2 OP n m a13.452; 9.631; 7.003
90; 90; 90		907.282Schultz, A. J.; Carlin, R. L.
Single-crystal pulsed neutron diffraction structure of the antiferromagnet K2[FeCl5(H2O)] with and without applied pressure Sample: P = .1 MPa Sample: T = 15 K
Acta Crystallographica, Section B, 1995, 51, 43-47
9011380 CIFCl5 Fe H2 K2 OP n m a13.391; 9.648; 6.942
90; 90; 90		896.881Schultz, A. J.; Carlin, R. L.
Single-crystal pulsed neutron diffraction structure of the antiferromagnet K2[FeCl5(H2O)] with and without applied pressure Sample: P = .14 GPa Sample: T = 15 K
Acta Crystallographica, Section B, 1995, 51, 43-47
9013161 CIFFe4 H4 K2 Mg2 Na2 O30 Si8 Ti2A 1 2 110.37; 23.129; 5.322
90; 99.55; 90		1258.78Shi, N.; Ma, Z.; Li, G.; Yamnova, M. A.; Pushcharovsky, D. Y.
Structure Refinement of Monoclinic Astrophyllite
Acta Crystallographica Section B, 1998, 54, 109-114
9013392 CIFMo Ni PP -6 2 m5.861; 5.861; 3.704
90; 90; 120		110.191Guerin, R.; Sergent, M.
Structure cristalline de NiMoP Localite: synthetic
Acta Crystallographica, Section B, 1977, 33, 2820-2823
9013393 CIFO2 SiF 19.932; 17.216; 81.864
90; 90; 90		13997.9Konnert, J. H.; Appleman, D. E.
The crystal structure of low tridymite
Acta Crystallographica, Section B, 1978, 34, 391-403
9013394 CIFSbR -3 m :H4.214; 4.214; 10.569
90; 90; 120		162.538Schiferl, D.; Cromer, D. T.; Jamieson, J. C.
Structure determinations on Sb up to 85 x 10^2 MPa Sample: at P = 6.3 GPa Note: known as the A7 rhombohedral-type structure
Acta Crystallographica, Section B, 1981, 37, 807-810
9013395 CIFSbR -3 m :H4.21; 4.21; 10.53
90; 90; 120		161.63Schiferl, D.; Cromer, D. T.; Jamieson, J. C.
Structure determinations on Sb up to 85 x 10^2 MPa Sample: at P = 6.8 GPa Note: known as the A7 rhombohedral-type structure
Acta Crystallographica, Section B, 1981, 37, 807-810
9013396 CIFSbR -3 m :H4.198; 4.198; 10.485
90; 90; 120		160.024Schiferl, D.; Cromer, D. T.; Jamieson, J. C.
Structure determinations on Sb up to 85 x 10^2 MPa Sample: at P = 7.15 GPa Note: known as the A7 rhombohedral-type structure
Acta Crystallographica, Section B, 1981, 37, 807-810
9013397 CIFSbR -3 m :H4.196; 4.196; 10.455
90; 90; 120		159.414Schiferl, D.; Cromer, D. T.; Jamieson, J. C.
Structure determinations on Sb up to 85 x 10^2 MPa Sample: at P = 7.7 GPa Note: known as the A7 rhombohedral-type structure
Acta Crystallographica, Section B, 1981, 37, 807-810
9013398 CIFMg2 O4 TiF d -3 m :28.4376; 8.4376; 8.4376
90; 90; 90		600.699Wechsler, B. A.; Von Dreele, R. B.
Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Sample: T = 973 K
Acta Crystallographica, Section B, 1989, 45, 542-549
9013890 CIFB2 Cu O4I -4 2 d11.484; 11.484; 5.62
90; 90; 90		741.178Martinez-Ripoll M; Martinez-Carrera S; Garcia-Blanco S
The crystal structure of copper metaborate, CuB2O4
Acta Crystallographica, Section B, 1971, 27, 677-681
9013891 CIFBa Cl FP 4/n m m :24.3939; 4.3939; 7.2248
90; 90; 90		139.485Sauvage, M.
Refinement of the structures of SrFCl and BaFCl Note: matlockite structure
Acta Crystallographica, Section B, 1974, 30, 2786-2787
9013892 CIFCl F SrP 4/n m m :24.1259; 4.1259; 6.9579
90; 90; 90		118.445Sauvage, M.
Refinement of the structures of SrFCl and BaFCl Note: matlockite structure
Acta Crystallographica, Section B, 1974, 30, 2786-2787
9013893 CIFAl3.88 Ge4.12 K0.76 Na3.12 O16P 6310.164; 10.164; 8.54
90; 90; 120		764.043Hammond, R. P.; Barbier, J.
Monoclinic and hexagonal nepheline structures of (Na3/4K1/4)AlGeO4 Note: hexagonal nepheline
Acta Crystallographica, Section B, 1998, 54, 211-220
9014079 CIFFe3 H20 K5 O35 S6P 1 21/c 19.491; 18.474; 18.109
90; 92.38; 90		3172.43Mereiter, K.; Vollenkle, H.
Die Kristallstruktur von beta-pentakalium-[mu3-oxo-hexa-mu-sulfato- triquatriesen(III)]-Heptahydrat - eine monokline Modifikation des Masschen Salzes
Acta Crystallographica, Section B, 1978, 34, 378-384
9014118 CIFNa Nb O3P b m a5.566; 15.52; 5.506
90; 90; 90		475.632Sakowski-Cowley A C; Lukaszewicz, K.; Megaw, H. D.
The structure of sodium niobate at room temperature, and the problem of reliability in pseudosymmetric structures
Acta Crystallographica, Section B, 1969, 25, 851-865
9014162 CIFO3 Sn SrP b n m5.707; 5.707; 8.064
90; 90; 90		262.643Vegas, A.; Vallet-Regi M; Gonzalez-Calbet J M; Alario-Franco M A
The ASnO3 (A = Ca, Sr) perovskites
Acta Crystallographica, Section B, 1986, 42, 167-172
9014175 CIFO2 PbP 42/m n m4.9577; 4.9577; 3.3879
90; 90; 90		83.27Bolzan, A. A.; Fong, C.; Kennedy, B. J.; Howard, C. J.
Structural studies of rutile-type metal dioxides
Acta Crystallographica, Section B, 1997, 53, 373-380
9014308 CIFAl6 Ca8.5 Na O18P b c a10.875; 10.859; 15.105
90; 90; 90		1783.77Nishi, F.; Takeuchi, Y.
The Al6O18 rings of tetrahedra in the structure of Ca8.5NaAl6O18
Acta Crystallographica, Section B, 1975, 31, 1169-1173
9014330 CIFHg I2P 42/n m c :24.365; 4.365; 12.389
90; 90; 90		236.05Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.
Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 200 K, powder neutron data
Acta Crystallographica, Section B, 2007, 63, 828-835
9014372 CIFAl6 B3 F Fe3 Na O30 Si6R 3 m :H15.869; 15.869; 7.188
90; 90; 120		1567.61Barton, R.
Refinement of the crystal structure of buergerite and the absolute orientation of tourmalines
Acta Crystallographica, Section B, 1969, 25, 1524-1533
9014392 CIFCa N2 O10P 1 21/n 16.277; 9.157; 14.484
90; 98.6; 90		823.158Ribar, B.; Divjakovic, V.; Herak, R.; Prelesnik, B.
A new crystal structure study of Ca(NO3)2*(H2O)
Acta Crystallographica, Section B, 1973, 29, 1546-1548
9014425 CIFAl4 Ca O7C 1 2/c 112.8398; 8.8624; 5.4311
90; 106.83; 90		591.542Goodwin, D. W.; Lindop, A. J.
The crystal structure of CaO.2Al2O3
Acta Crystallographica, Section B, 1970, 26, 1230-1235
9014434 CIFHg I2P 42/n m c :24.359; 4.359; 12.319
90; 90; 90		234.072Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.
Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 60 K, powder neutron data
Acta Crystallographica, Section B, 2007, 63, 828-835
9014462 CIFHg I2P 42/n m c :24.358; 4.358; 12.306
90; 90; 90		233.718Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.
Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 30 K, powder neutron data
Acta Crystallographica, Section B, 2007, 63, 828-835
9014545 CIFC H K O3P 1 21/a 115.1725; 5.6283; 3.711
90; 104.631; 90		306.626Thomas, J. O.; Tellgren, R.; Olovsson, I.
Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 298 K
Acta Crystallographica, Section B, 1974, 30, 1155-1166
9014580 CIFCu OC 1 2/c 14.6837; 3.4226; 5.1288
90; 99.54; 90		81.08Asbrink, S.; Norrby, L. J.
A refinement of the crystal structure of copper(II) oxide, with a discussion of some exceptional E.s.d.'s
Acta Crystallographica, Section B, 1970, 26, 8-15
9014630 CIFMn2 O4 SiP b n m4.9023; 10.5964; 6.2567
90; 90; 90		325.015Fujino, K.; Sasaki, S.; Takeuchi, Y.; Sadanaga, R.
X-ray determination of electron distributions in forsterite, fayalite and tephroite
Acta Crystallographica, Section B, 1981, 37, 513-518
9014655 CIFHg I2P 42/n m c :24.37; 4.37; 12.437
90; 90; 90		237.508Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.
Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 293 K, powder neutron data
Acta Crystallographica, Section B, 2007, 63, 828-835
9014660 CIFC D K O3P 1 21/a 115.1948; 5.6307; 3.7107
90; 104.567; 90		307.272Thomas, J. O.; Tellgren, R.; Olovsson, I.
Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 298 K
Acta Crystallographica, Section B, 1974, 30, 1155-1166
9014704 CIFCl Cu2 H3 O3P 1 21/n 16.1675; 6.8327; 9.1517
90; 99.492; 90		380.379Malcherek, T.; Schluter, J.
Structures of the pseudo-trigonal polymorphs of Cu2(OH)3Cl Note: Sample #1
Acta Crystallographica, Section B, 2009, 65, 334-341
9014807 CIFAl3.804 Ca1.359 H15.36 O31.68 Si8.304 Sr0.291R -3 m :R9.421; 9.421; 9.421
94.2; 94.2; 94.2		829.077Calligaris, M.; Nardin, G.; Randaccio, L.
Cation-site location in a natural chabazite
Acta Crystallographica, Section B, 1982, 38, 602-605
9014844 CIFC D K O3P 1 21/a 115.17; 5.6183; 3.6885
90; 104.297; 90		304.633Thomas, J. O.; Tellgren, R.; Olovsson, I.
Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 219 K
Acta Crystallographica, Section B, 1974, 30, 1155-1166
9014907 CIFC2 H5 N OR 3 c :H11.513; 11.513; 12.883
90; 90; 120		1478.85Jeffrey, G. A.; Ruble, J. R.; McMullan, R. K.; DeFrees, D. J.; Binkley, J. S.; Pople, J. A.
Neutron diffraction at 23 K and ab initio molecular-orbital studies of molecular structure of acetamide Note: T = 23 K
Acta Crystallographica, Section B, 1980, 36, 2292-2299
9015024 CIFMg0.125 O1.872 Zr0.875F m -3 m5.0858; 5.0858; 5.0858
90; 90; 90		131.546Howard, C. J.; Hill, R. J.; Reichert, B. E.
Structures of the ZrO2 polymorphs at room temperature by high-resolution neutron powder diffraction Note: model 3, O displaced along [111]
Acta Crystallographica, Section B, 1988, 44, 116-120
9015028 CIFB F4 H4 NP n m a9.077; 5.679; 7.279
90; 90; 90		375.22Caron, A. P.; Ragle, J. L.
Refinement of the structure of orthorhombic ammonium tetrafluoroborate, NH4BF4
Acta Crystallographica, Section B, 1971, 27, 1102-1107
9015117 CIFO0.984 Y0.065 Zr0.935P 42/n m c3.6055; 3.6055; 5.1797
90; 90; 90		67.334Howard, C. J.; Hill, R. J.; Reichert, B. E.
Structures of the ZrO2 polymorphs at room temperature by high-resolution neutron powder diffraction
Acta Crystallographica, Section B, 1988, 44, 116-120
9015119 CIFN4 O14 P2 TeP -111.51; 6.484; 6.329
118.15; 105.8; 84.36		400.48Durif, A.; Averbuch-Pouchot, M. T.; Guitel, J. C.
Structures de deux phosphotellurates. Te(OH)6((NH4)2HPO4)2 and Te(OH)6(Na2HPO4)(H2O)
Acta Crystallographica, Section B, 1979, 35, 1444-1447
9015122 CIFBi2 Pb3 S6B b m m13.535; 20.451; 4.104
90; 90; 90		1136.01Takagi, J.; Takeuchi, Y.
The crystal structure of lillianite
Acta Crystallographica, Section B, 1972, 28, 649-651
9015312 CIFAs2 Ca H4 O8P -18.558; 7.697; 5.721
92.35; 109.52; 109.59		329.621Ferraris, G.; Jones, D. W.; Yerkess, J.
A neutron diffraction study of the crystal structure of calcium bis(dihydrogen arsenate), Ca(H2AsO4)2
Acta Crystallographica, Section B, 1972, 28, 2430-2437
9015318 CIFCa0.74 Ce0.03 K0.6 Mg0.04 Mn0.2 Na0.9 O20 Pb0.01 Si8 Th0.88P 4/m c c7.58; 7.58; 14.77
90; 90; 90		848.631Prichard, P.; Perrault, G.
Structure cristalline de l'ekanite de St-Hilaire, P.Q.
Acta Crystallographica, Section B, 1972, 28, 1994-1999
9015332 CIFHg I2P 42/n m c :24.358; 4.358; 12.3
90; 90; 90		233.604Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.
Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 10 K, powder neutron data
Acta Crystallographica, Section B, 2007, 63, 828-835
9015404 CIFCa O3 SnP b n m5.532; 5.681; 7.906
90; 90; 90		248.464Vegas, A.; Vallet-Regi, M.; Gonzalez-Calbet, J. M.; Alario-Franco, M. A.
The ASnO3 (A = Ca, Sr) perovskites
Acta Crystallographica, Section B, 1986, 42, 167-172
9015414 CIFHg I2P 42/n m c :24.3675; 4.3675; 12.47
90; 90; 90		237.866Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.
Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 293 K, single crystal X-ray data
Acta Crystallographica, Section B, 2007, 63, 828-835
9015434 CIFMg0.125 O1.872 Zr0.875F m -3 m5.0858; 5.0858; 5.0858
90; 90; 90		131.546Howard, C. J.; Hill, R. J.; Reichert, B. E.
Structures of the ZrO2 polymorphs at room temperature by high-resolution neutron powder diffraction Note: model 2, O displaced along [100]
Acta Crystallographica, Section B, 1988, 44, 116-120
9015520 CIFCa17 N34 O122.96P 63/m13.226; 13.226; 32.37
90; 90; 120		4903.77Leclaire, A.
Structure cristalline d'un nouvel hydrate du nitrate de calcium Ca(NO3)2(H2O)1.235
Acta Crystallographica, Section B, 1976, 32, 1950-1953
9015643 CIFMg0.096 O1.904 Zr0.904F m -3 m5.0858; 5.0858; 5.0858
90; 90; 90		131.546Howard, C. J.; Hill, R. J.; Reichert, B. E.
Structures of the ZrO2 polymorphs at room temperature by high-resolution neutron powder diffraction Note: model 1, O atom not displaced
Acta Crystallographica, Section B, 1988, 44, 116-120
9015662 CIFO2 TiP 42/m n m4.5937; 4.5937; 2.9587
90; 90; 90		62.435Howard, C. J.; Sabine, T. M.; Dickson, F.
Structural and thermal parameters for rutile and anatase
Acta Crystallographica, Section B, 1991, 47, 462-468
9015676 CIFAs H O5 Zn2P -15.638; 5.827; 6.692
103.25; 104.37; 87.72		207.268Hawthorne, F. C.
Paradamite
Acta Crystallographica, Section B, 1979, 35, 720-722
9015698 CIFAl6.5 Ca5 Mg0.75 O17 Si0.75P m m n :227.638; 10.799; 5.123
90; 90; 90		1529.03Hanic, F.; Handlovic, M.; Kapralik, I.
The structure of a quaternary phase Ca20Al32-2vMgvSivO68
Acta Crystallographica, Section B, 1980, 36, 2863-2869
9015723 CIFHg I2P 42/n m c :24.36; 4.36; 12.337
90; 90; 90		234.521Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.
Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 100 K, powder neutron data
Acta Crystallographica, Section B, 2007, 63, 828-835
9015753 CIFAl Ca Fe9.38 H2 K0.75 Li0.12 Mg0.5 Mn4 Na4.11 O50 P12C 1 2/c 116.526; 10.057; 24.73
90; 105.78; 90		3955.27Merlino, S.; Mellini, M.; Zanazzi, P. F.
Structure of arrojadite, KNa4CaMn4Fe10Al(PO4)12(OH,F)2
Acta Crystallographica, Section B, 1981, 37, 1733-1736
9015780 CIFBa Cr2 O11 PP -19.333; 7.779; 7.526
106.28; 105.37; 94.14		499.356Averbuch-Pouchot, M. T.; Durif, A.; Guitel, J. C.
Existence d'un nouvel anion condense: Cr2PO10. Structures cristallines de deux phosphochromates de baryum: BaHCr2PO10*H2O et BaHCr2PO10*3H2O
Acta Crystallographica, Section B, 1977, 33, 1431-1435
9015889 CIFCa Cl2 H8 O4P -16.5932; 6.3673; 8.5606
97.83; 93.5; 110.58		331.003Leclaire, A.; Borel, M. M.
Liaisons hydrogene et coordination du calcium dans les cristaux de CaCl2*4H2O alpha
Acta Crystallographica, Section B, 1979, 35, 585-588
9015929 CIFO2 TiI 41/a m d :13.7845; 3.7845; 9.5143
90; 90; 90		136.268Howard, C. J.; Sabine, T. M.; Dickson, F.
Structural and thermal parameters for rutile and anatase
Acta Crystallographica, Section B, 1991, 47, 462-468
9015981 CIFCa O8 Ti Zr2.5I 41/a c d :215.2203; 15.2203; 10.1224
90; 90; 90		2344.93Rossell, H. J.
Calzirtite - A fluorite-related superstructure
Acta Crystallographica, Section B, 1982, 38, 593-595
9016039 CIFC H K O3P 1 21/a 115.115; 5.6044; 3.6609
90; 103.98; 90		300.931Thomas, J. O.; Tellgren, R.; Olovsson, I.
Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 95 K Note z-coordinate of O3 has been modified with a negative sign
Acta Crystallographica, Section B, 1974, 30, 1155-1166
9016041 CIFLi O8 Ta3C 1 2/c 19.41; 11.521; 5.0506
90; 91.108; 90		547.446Santoro, A.; Roth, R. S.; Minor, D.
Neutron powder diffraction study of the intermediate-temperature form of lithium tantalate
Acta Crystallographica, Section B, 1977, 33, 3945-3947
9016078 CIFN O12 P4 PrC 1 2/c 17.916; 12.647; 10.672
90; 110.34; 90		1001.79Masse, R.; Guitel, J. C.; Durif, A.
Structure cristalline du tetrametaphosphate de praseodyme-ammonium, PrN H4 P4 O12. Donnees cristallographiques de Pr N H4 P4 O12
Acta Crystallographica, Section B, 1977, 33, 630-632
9016142 CIFNa2 O11 P TeP 635.908; 5.908; 15.09
90; 90; 120		456.143Durif, A.; Averbuch-Pouchot, M. T.; Guitel, J. C.
Structures de deux phosphotellurates. Te(OH)6((NH4)2HPO4)2 and Te(OH)6(Na2HPO4)(H2O)
Acta Crystallographica, Section B, 1979, 35, 1444-1447
9016168 CIFN2 O13 P4 SiP -115.14; 7.684; 4.861
97.86; 96.74; 83.89		553.971Durif, A.; Averbuch-Pouchot, M. T.; Guitel, J. C.
Structure cristalline de (N H4)2 Si P4 O13: un nouvel exemple de silicium hexacoordine
Acta Crystallographica, Section B, 1976, 32, 2957-2960
9016304 CIFC H K O3P 1 21/a 115.1538; 5.6186; 3.6868
90; 104.356; 90		304.104Thomas, J. O.; Tellgren, R.; Olovsson, I.
Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 219 K
Acta Crystallographica, Section B, 1974, 30, 1155-1166
9016325 CIFH8 O10 P UP 4/n c c :26.995; 6.995; 17.491
90; 90; 90		855.835Morosin, B.
Hydrogen uranyl phosphate tetrahydrate, a hydrogen ion solid electrolyte
Acta Crystallographica, Section B, 1978, 34, 3732-3734
9016385 CIFMg2 O4 SiP b n m4.7534; 10.1902; 5.9783
90; 90; 90		289.577Fujino, K.; Sasaki, S.; Takeuchi, Y.; Sadanaga, R.
X-ray determination of electron distributions in forsterite, fayalite and tephroite
Acta Crystallographica, Section B, 1981, 37, 513-518
9016407 CIFBa Cr2 O13 PP -110.189; 8.207; 7.749
108.8; 107.14; 89.04		583.971Averbuch-Pouchot, M. T.; Durif, A.; Guitel, J. C.
Existence d'un nouvel anion condense: Cr2PO10. Structures cristallines de deux phosphochromates de baryum: BaHCr2PO10*H2O et BaHCr2PO10*3H2O
Acta Crystallographica, Section B, 1977, 33, 1431-1435
9016492 CIFGe O2P 42/m n m4.4066; 4.4066; 2.8619
90; 90; 90		55.573Bolzan, A. A.; Fong, C.; Kennedy, B. J.; Howard, C. J.
Structural studies of rutile-type metal dioxides
Acta Crystallographica, Section B, 1997, 53, 373-380
9016495 CIFCa Fe0.12 Mg0.88 O4 SiP n m a11.1098; 6.3894; 4.8281
90; 90; 90		342.722Pilati, T.; Demartin, F.; Gramaccioli, C. M.
Thermal parameters for minerals of the olivine group: their implication on vibrational spectra, thermodynamic functions and transferable force fields
Acta Crystallographica, Section B, 1995, 51, 721-733
9016501 CIFC D K O3P 1 21/a 115.1311; 5.6054; 3.6644
90; 103.953; 90		301.629Thomas, J. O.; Tellgren, R.; Olovsson, I.
Hydrogen-bond studies. LXXXIV. An X-ray diffraction study of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K Note: T = 95 K
Acta Crystallographica, Section B, 1974, 30, 1155-1166
9016581 CIFAs Fe H4 O6P c a b8.937; 10.278; 9.996
90; 90; 90		918.177Hawthorne, F. C.
The hydrogen positions in scorodite
Acta Crystallographica, Section B, 1976, 32, 2891-2892
9016626 CIFFe H10 N O11 S2P 1 21/c 19.982; 10.156; 9.504
90; 94.95; 90		959.895Palmer, K. J.; Wong, R. Y.; Lee, K. S.
The crystal structure of ferric ammonium sulfate trihydrate, FeNH4(SO4)2*3H2O Note: y-coordinate of O10 altered to reproduce reported bond lengths
Acta Crystallographica, Section B, 1972, 28, 236-241
9016633 CIFH1.333 Mg1.333 O5 SI 41/a m d :25.242; 5.242; 12.995
90; 90; 90		357.084Keefer, K. D.; Hochella, Jr, M. F.; de Jong, B. H. W. S.
The structure of the magnesium hydroxide sulfate hydrate MgSO4.1/3Mg(OH)2.1/3H2O
Acta Crystallographica, Section B, 1981, 37, 1003-1006
9016662 CIFAg4 Mn S6 Sb2P 1 21/n 110.31; 8.07; 6.62
90; 92.68; 90		550.193Hruskova, J.; Synecek, V.
The crystal structure of samsonite, 2 Ag2S*MnS*Sb2S3
Acta Crystallographica, Section B, 1969, 25, 1004-1006
9016666 CIFH2.3 Mg5 O10 Si2P 21/b 1 14.752; 10.35; 7.914
108.71; 90; 90		368.666Yamamoto, K.
The crystal structure of hydroxyl-chondrodite
Acta Crystallographica, Section B, 1977, 33, 1481-1485
9016702 CIFCu5 Li2 O14 Si4P -17.404; 7.754; 5.455
90.52; 106.27; 114.64		270.4Kawamura, K.; Kawahara, A.; Iiyama, J. T.
The crystal structure of Li2Cu5(Si2O7)2 and the proposal of new values for the effective iconic radii of Cu2+
Acta Crystallographica, Section B, 1978, 34, 3181-3185
9016714 CIFO2 ZrP 1 21/c 15.1505; 5.2116; 5.3173
90; 99.23; 90		140.881Howard, C. J.; Hill, R. J.; Reichert, B. E.
Structures of the ZrO2 polymorphs at room temperature by high-resolution neutron powder diffraction
Acta Crystallographica, Section B, 1988, 44, 116-120
9017294 CIFH16 Mg N O10 PP m n 216.941; 6.137; 11.199
90; 90; 90		477.043Whitaker, A.; Jeffery, J. W.
The crystal structure of struvite, MgNH4PO4*6H2O
Acta Crystallographica, Section B, 1970, 26, 1429-1440
9017295 CIFCa Cl2 O4P -16.593; 6.364; 8.557
97.77; 93.52; 110.56		330.776Thewalt, U.; Bugg, C. E.
Crystal structure of calcium chloride tetrahydrate
Acta Crystallographica, Section B, 1973, 29, 615-617
9017296 CIFH6 O8 S VP 1 21/c 17.411; 7.439; 12.272
90; 108.9; 90		640.084Theobald, F.; Galy, J.
Structure cristalline de VOSO4((H2O)3 Note: polymorph of bobjonesite
Acta Crystallographica, Section B, 1973, 29, 2732-2736
9017297 CIFCa O4 SB m m b6.992; 6.999; 6.24
90; 90; 90		305.367Morikawa, H.; Tomita, T.; Minato, I.; Iwai, S.
Anhydrite: a refinement
Acta Crystallographica, Section B, 1975, 31, 2164-2165
9017298 CIFO2 SiC 1 c 118.494; 4.991; 25.832
90; 117.75; 90		2110.15Kato, V. K.; Nukui, A.
Die kristallstruktur des monoklinen tief-tridymits
Acta Crystallographica, Section B, 1976, 32, 2486-2491
9017299 CIFAl0.94 K0.871 Na0.12 O8 Rb0.008 Si3.06C -18.567; 12.98; 7.2
90.07; 116.03; 89.75		719.417Dal Negro, A.; De Pieri, R.; Quareni, S.
The crystal structures of nine K feldspars from the Adamello Massif (Northern Italy) Note: Sample P17C
Acta Crystallographica, Section B, 1978, 34, 2699-2707
9017300 CIFAl0.95 Ba0.006 Ca0.005 K0.904 Na0.085 O8 Si3.05C -18.564; 12.984; 7.201
90.13; 116.02; 89.53		719.53Dal Negro, A.; De Pieri, R.; Quareni, S.
The crystal structures of nine K feldspars from the Adamello Massif (Northern Italy) Note: Sample A1D
Acta Crystallographica, Section B, 1978, 34, 2699-2707
9017301 CIFAl0.99 K0.94 Na0.06 O8 Si3.01C -18.56; 12.984; 7.209
90.28; 116.03; 89.03		719.851Dal Negro, A.; De Pieri, R.; Quareni, S.
The crystal structures of nine K feldspars from the Adamello Massif (Northern Italy) Note: Sample CA1B
Acta Crystallographica, Section B, 1978, 34, 2699-2707
9017302 CIFAl0.95 K0.94 Na0.06 O8 Si3.05C -18.574; 12.962; 7.21
90.35; 116.03; 88.8		719.85Dal Negro, A.; De Pieri, R.; Quareni, S.
The crystal structures of nine K feldspars from the Adamello Massif (Northern Italy) Note: Sample P1C
Acta Crystallographica, Section B, 1978, 34, 2699-2707
9017303 CIFAl0.99 K0.92 Na0.08 O8 Si3.01C -18.567; 12.97; 7.221
90.43; 116; 88.48		720.89Dal Negro, A.; De Pieri, R.; Quareni, S.
The crystal structures of nine K feldspars from the Adamello Massif (Northern Italy) Note: Sample RC20C
Acta Crystallographica, Section B, 1978, 34, 2699-2707
9017304 CIFAl1.01 K0.94 Na0.06 O8 Si2.99C -18.561; 12.972; 7.223
90.56; 115.93; 87.92		720.894Dal Negro, A.; De Pieri, R.; Quareni, S.
The crystal structures of nine K feldspars from the Adamello Massif (Northern Italy) Note: Sample CA1E
Acta Crystallographica, Section B, 1978, 34, 2699-2707
9017305 CIFAl1.01 K0.94 Na0.06 O8 Si2.99C -18.589; 13.013; 7.197
90; 116.02; 90		722.866Dal Negro, A.; De Pieri, R.; Quareni, S.
The crystal structures of nine K feldspars from the Adamello Massif (Northern Italy) Note: Sample P2B
Acta Crystallographica, Section B, 1978, 34, 2699-2707
9017306 CIFAl0.97 Ba0.005 Ca0.009 K0.931 Na0.055 O8 Si3.03C -18.583; 12.988; 7.202
90; 116.05; 90		721.29Dal Negro, A.; De Pieri, R.; Quareni, S.
The crystal structures of nine K feldspars from the Adamello Massif (Northern Italy) Note: Sample P2A
Acta Crystallographica, Section B, 1978, 34, 2699-2707
9017307 CIFAl1.005 Ba0.01 Ca0.01 K0.88 Na0.1 O8 Si2.995C -18.563; 12.99; 7.21
90; 115.93; 90		721.255Dal Negro, A.; De Pieri, R.; Quareni, S.
The crystal structures of nine K feldspars from the Adamello Massif (Northern Italy) Note: Sample CA1A
Acta Crystallographica, Section B, 1978, 34, 2699-2707
9017308 CIFH Na3 O8 S2P 1 21/c 18.648; 9.648; 9.143
90; 108.77; 90		722.284Catti, M.; Ferraris, G.; Ivaldi, G.
A very short, and asymmetrical, hydrogen bond in the structure of Na3H(SO4)2 and S-OH vs O-H...O correlation
Acta Crystallographica, Section B, 1979, 35, 525-529
9017310 CIFFe H6 O6 SP 1 21/n 16.604; 8.693; 8.714
90; 96.05; 90		497.472Johansson, L. G.; Lindqvist, O.
The crystal structure of iron(II) sulfite trihydrate, a-FeSO3.3H2O
Acta Crystallographica, Section B, 1979, 35, 1017-1020
9017311 CIFCl4 K2 ZnP n a 2126.778; 12.402; 7.256
90; 90; 90		2409.72Mikhail, I.; Peters, K.
The structure of potassium tetrachlorozincate
Acta Crystallographica, Section B, 1979, 35, 1200-1201
9017312 CIFCa O4 SA m m a7.006; 6.998; 6.245
90; 90; 90		306.18Kirfel, A.; Will, G.
Charge density in anhydrite, CaSO4, from X-ray and neutron diffraction measurements
Acta Crystallographica, Section B, 1980, 36, 2881-2890
9017313 CIFCa H4 O6 SI 1 2/c 15.679; 15.202; 6.522
90; 118.43; 90		495.153Pedersen, B. F.; Semmingsen, D.
Neutron diffraction refinement of the structure of gypsum, CaSO4*2H2O
Acta Crystallographica, Section B, 1982, 38, 1074-1077
9017314 CIFBeP 63/m m c2.2853; 2.2853; 3.5842
90; 90; 120		16.211Larsen, F. K.; Hansen, N. K.
Diffraction study of the electron density distribution in beryllium metal
Acta Crystallographica, Section B, 1984, 40, 169-179
9017315 CIFH16 Mg N O10 PP m n 216.955; 6.142; 11.218
90; 90; 90		479.206Abbona, F.; Calleri, M.; Ivaldi, G.
Synthetic struvite MgNH4PO4*6H2O: Correct polarity and surface features of some complementary forms
Acta Crystallographica, Section B, 1984, 40, 223-227
9017316 CIFC H4 N2 OP -4 21 m5.584; 5.584; 4.689
90; 90; 90		146.208Swaminathan, S.; Craven, B. M.
The crystal structure and molecular thermal motion of urea at 12, 60 and 123 K from neutron diffraction Note: neutron data, T = 123 K
Acta Crystallographica, Section B, 1984, 40, 300-306
9017317 CIFC H4 N2 OP -4 21 m5.57; 5.57; 4.688
90; 90; 90		145.445Swaminathan, S.; Craven, B. M.
The crystal structure and molecular thermal motion of urea at 12, 60 and 123 K from neutron diffraction Note: neutron data, T = 60 K
Acta Crystallographica, Section B, 1984, 40, 300-306
9017318 CIFC H4 N2 OP -4 21 m5.565; 5.565; 4.684
90; 90; 90		145.06Swaminathan, S.; Craven, B. M.
The crystal structure and molecular thermal motion of urea at 12, 60 and 123 K from neutron diffraction Note: neutron data, T = 12 K
Acta Crystallographica, Section B, 1984, 40, 300-306
9017319 CIFF3 LaP -3 c 17.185; 7.185; 7.351
90; 90; 120		328.648Zalkin, A.; Templeton, D. H.
Refinement of the trigonal structure of lanthanum trifluoride with neutron diffraction data Note: neutron data
Acta Crystallographica, Section B, 1985, 41, 91-93
9017320 CIFC14 H10P 1 21 18.441; 6.14; 9.438
90; 97.96; 90		484.437Petricek, V.; Cisarova, I.; Hummel, L.; Kroupa, J.; Brezina, B.
Oriental disorder in phenanthrene. Structure determination at 248, 295, 339 and 344 K
Acta Crystallographica, Section B, 1990, 46, 830-832
9017321 CIFAs K O5 TiP n a 2113.138; 6.582; 10.787
90; 90; 90		932.798Mayo, S. C.; Thomas, P. A.; Teat, S. J.; Loiacono, G. M.; Loiacono, D. N.
Structure and non-linear optical properties of KTiOAsO4
Acta Crystallographica, Section B, 1994, 50, 655-662
9017322 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2055; 10.2055; 7.4483
90; 90; 120		671.825Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 298 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017323 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2224; 10.2224; 7.4494
90; 90; 120		674.152Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 373 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017324 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2323; 10.2323; 7.4533
90; 90; 120		675.812Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 423 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017325 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2415; 10.2415; 7.4594
90; 90; 120		677.582Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 473 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017326 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2055; 10.2055; 7.4483
90; 90; 120		671.825Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 298 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017327 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2055; 10.2055; 7.4483
90; 90; 120		671.825Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 298 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017328 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2224; 10.2224; 7.4494
90; 90; 120		674.152Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 373 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017329 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2224; 10.2224; 7.4494
90; 90; 120		674.152Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 373 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017330 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2323; 10.2323; 7.4533
90; 90; 120		675.812Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 423 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017331 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2323; 10.2323; 7.4533
90; 90; 120		675.812Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 423 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017332 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2415; 10.2415; 7.4594
90; 90; 120		677.582Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 473 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017333 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2415; 10.2415; 7.4594
90; 90; 120		677.582Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 473 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017334 CIFC H O4 Pb1.5R -3 m :H5.2475; 5.2475; 23.6795
90; 90; 120		564.687Siidra, O.; Nekrasova, D.; Depmeier, W.; Chukanov, N.; Zaitsev, A.; Turner, R.
Hydrocerussite-related minerals and materials: structural principles, chemical variations and infrared spectroscopy
Acta Crystallographica, Section B, 2018, 74, 182-195
9017335 CIFC H O4 Pb1.5R -3 m :H5.257; 5.257; 23.636
90; 90; 120		565.693Siidra, O.; Nekrasova, D.; Depmeier, W.; Chukanov, N.; Zaitsev, A.; Turner, R.
Hydrocerussite-related minerals and materials: structural principles, chemical variations and infrared spectroscopy
Acta Crystallographica, Section B, 2018, 74, 182-195
9017336 CIFC2.3 Ba3 Ca26.433 F10.375 Na0.567 O68.375 P7.4 Si13R -3 m :H7.1255; 7.1255; 66.2902
90; 90; 120		2914.81Kruger, B.; Kruger, H.; Galuskin, E. V.; Galuskina, I. O.; Vapnik, Y.; Olieric, V.; Pauluhn, A.
Aravaite, Ba2Ca18(SiO4)6(PO4)3(CO3)F3O: modular structure and disorder of a new mineral with single and triple antiperovskite layers
Acta Crystallographica, Section B, 2018, 74, 492-501
9017337 CIFO2 SiC 2 2 218.7549; 5.0335; 8.2118
90; 90; 90		361.876Lee, S.; Xu, H.
Using powder XRD and pair distribution function to determine anisotropic atomic displacement parameters of orthorhombic tridymite and tetragonal cristobalite
Acta Crystallographica, Section B, 2019, 75
9017338 CIFO2 SiP 41 21 24.9727; 4.9727; 6.9257
90; 90; 90		171.257Lee, S.; Xu, H.
Using powder XRD and pair distribution function to determine anisotropic atomic displacement parameters of orthorhombic tridymite and tetragonal cristobalite
Acta Crystallographica, Section B, 2019, 75
9017916 CIFFe H5 O7 SP 21 21 217.2226; 7.393; 20.0542
90; 90; 90		1070.83Plasil, J.; Petricek, V.; Majzlan, J.
A commensurately modulated structure of parabutlerite, Fe3+SO4(OH)*2H2O
Acta Crystallographica, Section B, 2017, 73, 856-862
9017922 CIF
Paper		Cl4 Cu O12 Pb5 Se4C 1 2/c 124.917; 5.506; 14.242
90; 101.77; 90		1912.82Gemmi, Mauro; Campostrini, Italo; Demartin, Francesco; Gorelik, Tatiana E.; Gramaccioli, Carlo Maria
Structure of the new mineral sarrabusite, Pb~5~CuCl~4~(SeO~3~)~4~, solved by manual electron-diffraction tomography
Acta Crystallographica Section B, 2012, 68, 15-23

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