# cif

formula: Se N2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010185
formula_title: Cl6 H8 N2 Se
a: 9.935
b: 9.935
c: 9.935
alpha: 90
beta: 90
gamma: 90
cell_volume: 980.627
crystal_density: 2.165
atoms_sites: ["Se1", "N1", "Cl1"]
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formula: Se Rb2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010186
formula_title: Cl6 Rb2 Se
a: 9.978
b: 9.978
c: 9.978
alpha: 90
beta: 90
gamma: 90
cell_volume: 993.414
crystal_density: 3.093
atoms_sites: ["Se1", "Rb1", "Cl1"]
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formula: Se Cs2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010187
formula_title: Cl6 Cs2 Se
a: 10.260
b: 10.260
c: 10.260
alpha: 90
beta: 90
gamma: 90
cell_volume: 1080.046
crystal_density: 3.428
atoms_sites: ["Se1", "Cs1", "Cl1"]
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formula: Te K2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010188
formula_title: Cl6 K2 Te
a: 7.17
b: 7.17
c: 10.14
alpha: 90
beta: 90.
gamma: 90
cell_volume: 521.286
crystal_density: 2.666
atoms_sites: ["Te1", "K1", "Cl1", "Cl2"]
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formula: Te N2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010189
formula_title: Cl6 H8 N2 Te
a: 10.178
b: 10.178
c: 10.178
alpha: 90
beta: 90
gamma: 90
cell_volume: 1054.356
crystal_density: 2.320
atoms_sites: ["Te1", "N1", "Cl1"]
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formula: Te Rb2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010190
formula_title: Cl6 Rb2 Te
a: 10.233
b: 10.233
c: 10.233
alpha: 90
beta: 90
gamma: 90
cell_volume: 1071.541
crystal_density: 3.169
atoms_sites: ["Te1", "Rb1", "Cl1"]
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formula: Te Cs2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010191
formula_title: Cl6 Cs2 Te
a: 10.445
b: 10.445
c: 10.445
alpha: 90
beta: 90
gamma: 90
cell_volume: 1139.529
crystal_density: 3.533
atoms_sites: ["Te1", "Cs1", "Cl1"]
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formula: Te Tl2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010192
formula_title: Cl6 Te Tl2
a: 10.107
b: 10.107
c: 10.107
alpha: 90
beta: 90
gamma: 90
cell_volume: 1032.445
crystal_density: 4.819
atoms_sites: ["Te1", "Tl1", "Cl1"]
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formula: Ti Rb2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010193
formula_title: Cl6 Rb2 Ti
a: 9.922
b: 9.922
c: 9.922
alpha: 90
beta: 90
gamma: 90
cell_volume: 976.782
crystal_density: 2.934
atoms_sites: ["Ti1", "Rb1", "Cl1"]
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formula: Ti Cs2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010194
formula_title: Cl6 Cs2 Ti
a: 10.219
b: 10.219
c: 10.219
alpha: 90
beta: 90
gamma: 90
cell_volume: 1067.149
crystal_density: 3.276
atoms_sites: ["Ti1", "Cs1", "Cl1"]
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formula: Zr Cs2 Cl6
compound: <missing>
pub_title: Die Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010196
formula_title: Cl6 Cs2 Zr
a: 10.407
b: 10.407
c: 10.407
alpha: 90
beta: 90
gamma: 90
cell_volume: 1127.137
crystal_density: 3.358
atoms_sites: ["Zr1", "Cs1", "Cl1"]
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qdat:
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formula: Zn Cl2 N2
compound: <missing>
pub_title: Die Kristallstrukturen von Zn(NH3)2Cl2 und Zn(NH3)2Br2 _cod_database_code 1010197
formula_title: Zn(NH3)2Cl2
a: 7.78
b: 8.5
c: 8.08
alpha: 90
beta: 90
gamma: 90
cell_volume: 534.330
crystal_density: 2.042
atoms_sites: ["Zn1", "Cl1", "N1"]
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formula: Zn Br2 N2
compound: <missing>
pub_title: Die Kristallstrukturen von Zn(NH3)2Cl2 und Zn(NH3)2Br2 _cod_database_code 1010198
formula_title: Zn(NH3)2Br2
a: 8.12
b: 8.81
c: 8.41
alpha: 90
beta: 90
gamma: 90
cell_volume: 601.628
crystal_density: 2.796
atoms_sites: ["Zn1", "Br1", "N1"]
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formula: Cr Cl3 O6
compound: <missing>
formula_title: Cl3 Cr H12 O6
a: 7.95
b: 7.95
c: 7.95
alpha: 97.00
beta: 97.00
gamma: 97.00
cell_volume: 490.207
crystal_density: 1.723
atoms_sites: ["Cr1", "Cl1", "O1"]
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pub_title:
 Kristallhydrate. II.Die Struktur von Chromchlorid- und
 Aluminiumchloridhexahydrat.
 _cod_database_code 1010199

qdat:
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formula: Ti Cl4 N4
compound: <missing>
pub_title: An X-Ray Examination of Titanium Nitride. II. _cod_database_code 1010200
formula_title: Cl4 H12 N4 Ti
a: 7.72
b: 7.72
c: 7.72
alpha: 90
beta: 90
gamma: 90
cell_volume: 460.100
crystal_density: 1.774
atoms_sites: ["Ti1", "Cl1", "Cl2", "N1"]
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qdat:
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formula: Au Cs Cl3
compound: <missing>
formula_title: Au2 Cl6 Cs2
a: 7.49
b: 7.49
c: 10.87
alpha: 90
beta: 90
gamma: 90
cell_volume: 609.808
crystal_density: 4.752
atoms_sites: ["Au1", "Au2", "Cs1", "Cl1", "Cl2"]
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atoms_y: AAAAAAAAAACAhB4AAAAAAIDqDQA=
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pub_title:
 The Crystal Structure of Cesium Aurous Auric Chloride, Vs2 Au Au
 Cl6, and Cesium Argentous Auric Chloride, Cs2 Ag Au Cl6
 _cod_database_code 1010201

qdat:
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formula: Au Ag Cs2 Cl6
compound: <missing>
formula_title: Ag Au Cl6 Cs2
a: 7.38
b: 7.38
c: 11.01
alpha: 90
beta: 90
gamma: 90
cell_volume: 599.653
crystal_density: 4.339
atoms_sites: ["Au1", "Ag1", "Cs1", "Cl1", "Cl2"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAIBtDQA=
atoms_y: AAAAAAAAAACAhB4AAAAAAIBtDQA=
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pub_title:
 The Crystal Structure of Cesium Aurous Auric Chloride, Cs2 Au Au
 Cl6, and Cesium Argentous Auric Chloride, Cs2 Ag Au Cl6
 _cod_database_code 1010202

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formula: I K F2 O2
compound: <missing>
pub_title: The Crystal Structure of Potassium Fluoroiodate, K I O2 F2 _cod_database_code 1010203
formula_title: F2 I K O2
a: 8.38
b: 5.97
c: 8.41
alpha: 90
beta: 90
gamma: 90
cell_volume: 420.741
crystal_density: 3.726
atoms_sites: ["I1", "K1", "F1", "F2", "O1", "O2"]
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formula: Nd Br3 O18
compound: <missing>
pub_title: The Crystal Structure of Neodymium Enneahydrate, Nd (Br O3)3 (H2 O)9 _cod_database_code 1010204
formula_title: Br3 H18 Nd O18
a: 11.73
b: 11.73
c: 6.76
alpha: 90
beta: 90
gamma: 120
cell_volume: 805.514
crystal_density: 2.770
atoms_sites: ["Nd1", "Br1", "O1", "O2", "O3", "O4", "O5"]
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qdat:
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formula: Si Ba F6
compound: <missing>
formula_title: Ba F6 Si
a: 4.75
b: 4.75
c: 4.75
alpha: 97.97
beta: 97.97
gamma: 97.97
cell_volume: 103.741
crystal_density: 4.472
atoms_sites: ["Si1", "Ba1", "F1"]
atoms_x: AAAAAICEHgBAf/D/
atoms_y: AAAAAICEHgBAf/D/
atoms_z: AAAAAICEHgAgMAUA
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pub_title:
 Structures of Complex Fluorides. Barium Fluorosilicate and Barium
 Fluorogermanate
 _cod_database_code 1010205

qdat:
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formula: Ge Ba F6
compound: <missing>
formula_title: Ba F6 Ge
a: 4.83
b: 4.83
c: 4.83
alpha: 98.02
beta: 98.02
gamma: 98.02
cell_volume: 109.023
crystal_density: 4.934
atoms_sites: ["Ge1", "Ba1", "F1"]
atoms_x: AAAAAICEHgAgMfD/
atoms_y: AAAAAICEHgAgMfD/
atoms_z: AAAAAICEHgDAPwUA
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pub_title:
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pub_title: The Stereochemistry of Quadricovalent Atoms: Tervalent Gold _cod_database_code 1010207
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pub_title: The Green Salt of Magnus, and Some Related Compounds _cod_database_code 1010208
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pub_title:
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pub_title:
 The Valency Angle of Bivalent Lead: The Crystal Structure of Ammonium,
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formula: La C O3 F
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pub_title: Ueber die Kristallstruktur von Bastnaesit _cod_database_code 1010212
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formula: Sn Ni Cl6 O6
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pub_title: On the crystal structure of nickel chlorostannate hexahydrate _cod_database_code 1010213
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formula: Na Cl O4
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pub_title: The Crystal Structure of Sodium Perchlorate, Na Cl O4 _cod_database_code 1010214
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pub_title: The structure of melitite (Ca,Na)2(Mg,Al)(Si,Al)2O7 _cod_database_code 1010215
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pub_title: The Crystal Structure of Sodium Chlorate _cod_database_code 1010216
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formula: K Cl O2
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pub_title: The Crystal Structure of Potassium Chlorate _cod_database_code 1010217
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 The Configuration of the Triiodide Group in Ammonium Triiodide Crystals.
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 The Crystal Structure of Lithium Sulphate Mono-Hydrate, Li2 S O4
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pub_title: Die Struktur von Magnesiumchlorid- und Magnesiumbromidhexahydrat. _cod_database_code 1010257
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pub_title: Die Kristallstruktur des Silbernitrits. _cod_database_code 1010262
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formula: Cd Cl O
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pub_title: The Crystal Structure of Cadmium Hydroxychloride, Cd O H Cl _cod_database_code 1010263
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formula: Re K2 Cl6
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pub_title: Ueber die Kristallstruktur von K2 Re Cl6 _cod_database_code 1010264
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formula: Zr Si2
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pub_title: Die Struktur des Zirkoniumsilicids Zr Si2 _cod_database_code 1010265
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formula: Al P3 O9
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pub_title: The Crystal Structure of Aluminum Metaphosphate, Al (P O3)3 _cod_database_code 1010266
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formula: Co O2
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pub_title: Ueber Aenderungen der Ionenabstaende in Hydroxyd-Schichtengittern. _cod_database_code 1010267
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formula: Ba S3
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pub_title: The Structure of Polysulfides: I. Barium Trisulfide _cod_database_code 1010269
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formula: Ag Co N6 O8
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formula_title: Ag Co H6 N6 O8
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c: 10.43
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gamma: 90
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pub_title:
 The crystal structure of silver diammino-tetranitro-cobaltiate
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formula: N
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pub_title: The Crystal Structure of Ammonium Azide, N H4 N3 _cod_database_code 1010271
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formula: Si S4
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pub_title: Siliciumdisulfid, ein anorganischer Faserstoff mit Kettenmolekuelen. _cod_database_code 1010272
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formula: Al5 C3 N
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pub_title: Die Struktur des Aluminiumcarbonitrids Al5 C3 N _cod_database_code 1010273
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formula: F N
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pub_title: Die Kristallstruktur des Ammoniumfluorids. _cod_database_code 1010274
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pub_title: Roentgenographische Untersuchungen von Sn S2, Ti S2, Ti Se2, Ti Te2 _cod_database_code 1010275
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formula: La2 O3
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formula_title: La2 O3
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pub_title:
 Die Kristallstruktur der A-Modifikation von den Sesquioxyden der
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pub_title:
 Die Kristallstruktur der A-Modifikation von den Sesquioxiden der
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pub_title:
 Die Kristallstruktur der A-Modifikation von den Sesquioxiden der
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pub_title:
 Die Kristallstruktur der A-Modifikation von den Sesquioxiden der
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formula: Mo Si2
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pub_title: Ueber die Kristallstruktur von Mo Si2 und W Si2 _cod_database_code 1010282
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formula: W Si2
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pub_title:
 Die Struktur des kristallisierten Natriumhydrofluorids und die Gestalt
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pub_title: Die kristallchemische Verwandtschaft zwischen Germanium und Silicium. _cod_database_code 1010285
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismutiden des
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismutiden des
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismutiden des
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismutiden des
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismutiden des
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismutiden des
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismutiden des
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismutiden des
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismutiden des
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pub_title:
 Konstitution von Phosphiden, Arseniden, Antimoniden und Wismuthiden des
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 The Structure of the Hypophosphite Group as Determined from the Crystal
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pub_title:
 Die Atomanordnung in den tetragonalen Kristallen von K2 J2 O8,
 Kaliummetaperjodat.
 _cod_database_code 1010306

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pub_title:
 Roentgenographische Untersuchung der Struktur des Ammonium-Chlor-
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 _cod_database_code 1010307

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pub_title: Sur la structure de l'isocyanate de sodium. _cod_database_code 1010310
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pub_title: X-Ray Studies of Bismuth Trioxide _cod_database_code 1010311
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pub_title: X-Ray Studies on Bismuth Trioxide _cod_database_code 1010312
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pub_title: X-Ray Studies on Bismuth Trioxide _cod_database_code 1010313
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pub_title:
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pub_title:
 Roentgenographische Strukturuntersuchungen von Ultramarinblau und
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pub_title:
 Roentgenographische Strukturuntersuchungen von Ultramarinblau und
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pub_title:
 Die Atomanordnung des Kupferkieses und die Struktur der
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 Kristalle
 _cod_database_code 1010318

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formula: Ge I2
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pub_title: The Structure of Germanous Iodide _cod_database_code 1010319
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formula: Ba Ni C4 O4
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formula_title: Ba H8 N4 Ni O4
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c: 6.63
alpha: 90
beta: 104.83
gamma: 90
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pub_title:
 Structure cristalline des cyanures doubles de baryum a base de platine,
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 _cod_database_code 1010320

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pub_title: Srtucture du bromure double de cuivre et d'ammonium. _cod_database_code 1010321
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pub_title:
 The Crystal Structure and Magnetic Susceptibility of Caesium Argentous
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 _cod_database_code 1010322

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pub_title:
 The Crystal Structure and Magnetic Susceptibility of Caesium Argentous
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 _cod_database_code 1010323

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pub_title: The Crystal Structure of Silver Phosphate _cod_database_code 1010324
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pub_title:
 The Atomic Distribution in Red and Black Phosphorus and the Crystal
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pub_title: Struttura e costituzione chimica di alcuni ferrocianuri _cod_database_code 1010373
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pub_title: Struttura e costituzione chimica di alcuni ferrocianuri _cod_database_code 1010374
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formula: Co2 Fe C6 N6
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pub_title: Struttura e costituzione chimica di alcuni ferrocianuri _cod_database_code 1010375
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formula: Cd Cl3 N
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pub_title: The Crystal Structure of Ammonium Cadmium Chloride, N H4 Cd Cl3 _cod_database_code 1010376
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formula: Na Cl O3
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pub_title: The Crystal Structures of Sodium Chlorate and Sodium Bromate _cod_database_code 1010377
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formula: Na Br O3
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pub_title: The Crystal Structures of Sodium Chlorate and Sodium Bromate _cod_database_code 1010378
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formula: Pt Cl6 N2
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pub_title: The Crystal Structure of Ammonium Chloroplatinate _cod_database_code 1010379
formula_title: Cl6 H8 N2 Pt
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formula: Ni O
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pub_title: An X-Ray Investigation of the System Cr2O3 - NiO _cod_database_code 1010381
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formula: Pb2 O
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pub_title: Il sottossido di piombo _cod_database_code 1010382
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formula: Sr O10
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formula_title: H18 O10 Sr
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c: 5.807
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pub_title:
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formula: Sr O10
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formula_title: H16 O10 Sr
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pub_title:
 Struttura degli idrossidi ed idrati. - Nota IV. Sul perossido di
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formula: H Br
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pub_title: Struttura e polimorfismo degli acidi alogenidrici _cod_database_code 1010386
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formula: H Cl
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pub_title: Struttura e polimorfismo degli acidi alogenidrici _cod_database_code 1010387
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formula: H Cl
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pub_title: Struttura e polimorfismo degli acidi alogenidrici _cod_database_code 1010388
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formula: Cs2 Ge Cl6
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formula_title: Cl6 Cs2 Ge
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formula: N F2 H
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pub_title: A Redetermination of the Parameters in Ammonium Bifluoride _cod_database_code 1010390
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formula: Mn O
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pub_title: Die Kristallstrukturen einiger Verbindungen vom K2 Pt Cl6 - Typ _cod_database_code 1010396
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formula: Rb2 Te Cl6
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pub_title: Die Kristallstrukturen einiger Verbindungen vom K2 Pt Cl6 - Typ _cod_database_code 1010397
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formula: Rb2 Pt Cl6
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formula: Rb2 Pb Cl6
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pub_title: Die Kristallstrukturen einiger Verbindungen vom K2 Pt Cl6 - Typ _cod_database_code 1010399
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formula: Cs2 Te Cl6
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pub_title: Die Kristallstrukturen einiger Verbindungen vom K2 Pt Cl6 - Typ _cod_database_code 1010401
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formula: Cs2 Pt Cl6
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pub_title: Die Kristallstrukturen einiger Verbindungen vom K2 Pt Cl6 - Typ _cod_database_code 1010402
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formula: Cs2 Pb Cl6
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pub_title: Die Kristallstrukturen einiger Verbindungen vom K2 Pt Cl6 - Typ _cod_database_code 1010403
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formula: N I
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pub_title: Ein Umwandlungspunkt der Ammoniumsalze zwischen -30 und -40 Grad _cod_database_code 1010404
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formula: Ca N
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pub_title: Zur Kristallstruktur der Calcium - Stickstoffverbindungen _cod_database_code 1010405
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formula: Ba Ce O3
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pub_title: Sauerstoffsaeuren des vierwertigen Cerium und Thorium _cod_database_code 1010406
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formula: Ba Th O3
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pub_title: Sauerstoffsaeuren des vierwertigen Cerium und Thorium _cod_database_code 1010407
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formula: Si S2
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pub_title: Die Struktur des Siliciumdisulfids _cod_database_code 1010409
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formula: Nb O
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pub_title: Ueber die Oxyde des Niobs _cod_database_code 1010410
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formula: P
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pub_title: Crystal Structure of Phosphorus Pentachloride _cod_database_code 1010411
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formula: Mg2 Si
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pub_title: The atomic structure of two intermetallic compounds _cod_database_code 1010412
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formula: Al F3
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formula_title: Al F3
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pub_title:
 Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and
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formula: Fe F3
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pub_title:
 Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and
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formula: Co F3
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pub_title:
 Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and
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formula: Rh F3
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pub_title:
 Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and
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formula: Pd F3
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pub_title:
 Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and
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formula: Na W O3
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gamma: 90
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pub_title:
 The Spinels and the Cubic Sodium - Tungsten Bronzes as New Examples of
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formula: Na.35 W O3
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pub_title:
 The Spinels and the Cubic Sodium - Tungsten Bronzes as New Examples of
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formula: Ba Te
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beta: 90
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pub_title:
 Lichtbrechungsbestimmungen an den Erdalkaliverbindungen mit O, S, Se und Te
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formula: Sr Zr O3
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pub_title: Groessenunterschied der Ionen von Zirkonium und Hafnium _cod_database_code 1010424
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gamma: 90
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formula: Sr Hf O3
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pub_title: Groessenunterschied der Ionen von Zirkonium und Hafnium _cod_database_code 1010425
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formula: Cs Re
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pub_title: Die Kristallstruktur der Alkaliperrhenate und -periodate _cod_database_code 1010426
formula_title: Cs O4 Re
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formula: Tl Re
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pub_title: Die Kristallstruktur der Alkaliperrhenate und -periodate _cod_database_code 1010427
formula_title: O4 Re Tl
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b: 5.791
c: 13.295
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crystal_density: 5.993
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formula: Cs I
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pub_title: Die Kristallstruktur der Alkaliperrhenate und -periodate _cod_database_code 1010428
formula_title: Cs I O4
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formula: K (Al.99 Si2.01) O6
compound: <missing>
formula_title: <missing>
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b: 13.40
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beta: 90
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pub_title:
 Etude cristallographique d'une leucite artificielle. Structure atomique
 et symetrie du mineral
 _cod_database_code 1010431

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formula: (Fe.5 Ni.5) S
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formula_title: Fe Ni S2
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pub_title:
 Roentgenographische Untersuchungen der Kristallstrukturen von Magnetkies,
 Breithauptit, Pentlandit, Millerit und verwandten Verbindungen
 _cod_database_code 1010432

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formula: (Fe.5 Co.5) S
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formula_title: Co Fe S2
a: 3.36
b: 3.36
c: 5.29
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pub_title:
 Roentgenographische Untersuchungen der Kristallstrukturen von Magnetkies,
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formula: Fe (S.5 Se.5)
compound: <missing>
formula_title: Fe2 S Se
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pub_title:
 Roentgenographische Untersuchungen der Kristallstrukturen von Magnetkies,
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formula: Ni S
compound: Synthetic
formula_title: <missing>
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b: 3.42
c: 5.3
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beta: 90
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cell_volume: 53.686
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pub_title:
 Roentgenographische Untersuchungen der Kristallstrukturen von Magnetkies,
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formula: Mn O
compound: <missing>
pub_title: Temperaturabhaengigkeit der Gitterkonstanten von Manganoxyd _cod_database_code 1010436
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formula: Ca B2 O4
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pub_title: The Crystal Lattice of Calcium Metaborate, Ca B2 O4 _cod_database_code 1010437
formula_title: B2 Ca O4
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b: 11.6
c: 4.28
alpha: 90
beta: 90
gamma: 90
cell_volume: 307.321
crystal_density: 2.717
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formula: Ag Mn O4
compound: <missing>
pub_title: Die Struktur des Silberpermanganats Ag Mn O4 _cod_database_code 1010440
formula_title: Ag Mn O4
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b: 8.27
c: 7.127
alpha: 90
beta: 92
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formula: N Cl Br I
compound: <missing>
formula_title: Br Cl H4 I N
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b: 8.5
c: 9.94
alpha: 90
beta: 90
gamma: 90
cell_volume: 517.924
crystal_density: 3.287
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pub_title:
 The crystal structure of Ammonium Chlorobromoiodide and the
 Configuration of the Chlorobromoiodide Group
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formula: K I Cl4
compound: <missing>
formula_title: Cl4 I K
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b: 14.18
c: 4.2
alpha: 90
beta: 95.116
gamma: 90
cell_volume: 776.482
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pub_title:
 The Configuration of the Pentahalogen Anion Group from the X-ray
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formula: Cr Cs2 O4
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pub_title: The Crystal Structure of Caesium Chromate Cs2 Cr O4 _cod_database_code 1010443
formula_title: Cr Cs2 O4
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b: 11.135
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formula: Al5 Co2
compound: <missing>
pub_title: The Crystal Structure of Co2 Al5 _cod_database_code 1010445
formula_title: Al5 Co2
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b: 7.656
c: 7.539
alpha: 90
beta: 90
gamma: 120
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formula: Na Br O3
compound: <missing>
pub_title: The Crystal Structure of Sodium Bromate _cod_database_code 1010446
formula_title: Br Na O3
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b: 6.71
c: 6.71
alpha: 90
beta: 90
gamma: 90
cell_volume: 302.112
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formula: Pd Cl2
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pub_title: The Crystal Structure of Palladous Chloride Pd Cl2 _cod_database_code 1010447
formula_title: Cl2 Pd
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b: 3.34
c: 11.
alpha: 90
beta: 90
gamma: 90
cell_volume: 139.979
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formula: Na C N
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pub_title: Die Kristallstruktur des Na C N _cod_database_code 1010448
formula_title: N Na
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b: 4.71
c: 5.61
alpha: 90
beta: 90
gamma: 90
cell_volume: 98.822
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formula: Ca Al2
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pub_title: Die Kristallstruktur von Al2 Ca _cod_database_code 1010450
formula_title: Al2 Ca
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b: 8.02
c: 8.02
alpha: 90
beta: 90
gamma: 90
cell_volume: 515.850
crystal_density: 2.422
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formula: Sc F3
compound: <missing>
pub_title: Die Kristallstruktur des ScF3 _cod_database_code 1010451
formula_title: F3 Sc
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b: 4.022
c: 4.022
alpha: 89.575
beta: 89.575
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formula: Ti Ni3
compound: <missing>
pub_title: Die Kristallstruktur von Ni3 Ti und Si2 Ti _cod_database_code 1010452
formula_title: Ni3 Ti
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b: 5.096
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beta: 90
gamma: 120
cell_volume: 186.757
crystal_density: 7.965
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formula: Ti Si2
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pub_title: Die Kristallstruktur von Ni3 Ti und Si2 Ti _cod_database_code 1010453
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formula: Li10 Pb3
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pub_title: La fase gamma della lega litio-piombo Li10 Pb3 _cod_database_code 1010455
formula_title: Li10 Pb3
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formula: Li O2
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pub_title: Crystal Structure of Lithium Hydroxide Monohydrate _cod_database_code 1010456
formula_title: H3 Li O2
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formula: K P O4 H2
compound: <missing>
formula_title: <missing>
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b: 7.43
c: 6.97
alpha: 90
beta: 90
gamma: 90
cell_volume: 384.778
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pub_title:
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formula: Hg Ag2 I4
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formula_title: Ag2 Hg I4
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b: 6.340
c: 6.340
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beta: 90
gamma: 90
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pub_title:
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formula: Hg Cu2 I4
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formula_title: Cu2 Hg I4
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b: 6.08
c: 6.135
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pub_title:
 Strukturbestimmung der komplexen Quecksilber-Verbindungen Ag2 Hg I4
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formula: Tl F
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pub_title: Die Kristallstruktur des Thallofluorids _cod_database_code 1010462
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formula: Re2 Cd O8 N4
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formula_title: Cd H12 N4 O8 Re2
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b: 10.53
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gamma: 90
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pub_title:
 The Crystal Structure of Tetraamminocadmium Perrhenate, Cd(NH3)4(ReO4)2
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formula: Zr O7 P2
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pub_title: Struttura Cristallographica del Gruppo Isomorpho (Si,Ti,Zr,Sn,Hf) P2O7 _cod_database_code 1010464
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formula: Al F3
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pub_title: Die Kristallstruktur der Aluminiumhalogenide _cod_database_code 1010465
formula_title: Al F3
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b: 5.029
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formula: O4 S Li2
compound: <missing>
pub_title: The Crystal Structure of Lithium Sulphate _cod_database_code 1010467
formula_title: Li2 O4 S
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b: 4.95
c: 8.44
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beta: 107.9
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formula: Ca B2 O4
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pub_title: The Crystal Structure of Calcium Metaborate Ca B2 O4 _cod_database_code 1010468
formula_title: B2 Ca O4
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b: 11.60
c: 4.28
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formula: Pb Br F
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pub_title: Die Kristallstruktur von Bleifluobromid Pb F Br _cod_database_code 1010469
formula_title: Br F Pb
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b: 4.180
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beta: 90
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formula: Hg Br2
compound: <missing>
pub_title: Zur Kristallstruktur des Quecksilberbromids Hg Br2 _cod_database_code 1010470
formula_title: Br2 Hg
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b: 6.789
c: 12.445
alpha: 90
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formula: Mn P
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pub_title: Phosphides and Arsenides with modified Nickel-Arsenide Structure _cod_database_code 1010473
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formula: Fe2 B
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pub_title: Roentgenanalyse der Systeme Eisen-Bor, Kobalt-Bor und Nickel-Bor _cod_database_code 1010474
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c: 4.24
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formula: Co2 B
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pub_title: Roentgenanalyse der Systeme Eisen-Bor, Kobalt-Bor und Nickel-Bor _cod_database_code 1010475
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formula: Ni2 B
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pub_title: Roentgenanalyse der Systeme Eisen-Bor, Kobalt-Bor und Nickel-Bor _cod_database_code 1010476
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formula: Co B
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pub_title: Roentgenanalyse der Systeme Eisen-Bor, Kobalt-Bor und Nickel-Bor _cod_database_code 1010478
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formula: K S N O3
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pub_title: The Crystal Structure of Potassium Sulphamate _cod_database_code 1010479
formula_title: H2 K N O3 S
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b: 8.28
c: 5.9
alpha: 90
beta: 90
gamma: 90
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formula: Fe2 C9 O9
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pub_title: The crystal structure of iron enneacarbonyl _cod_database_code 1010480
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b: 6.45
c: 15.98
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beta: 90
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pub_title: The Structure of Caesium Cobalt Chloride ( Cs3 Co Cl5 ) _cod_database_code 1010481
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pub_title: The Stereochemistry of Quadricovalent Atoms: Copper and Silver _cod_database_code 1010482
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pub_title: The Stereochemistry of Quadricovalent Atoms: Copper and Silver _cod_database_code 1010483
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formula: Mg (O2 H2)
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pub_title: Ueber die Struktur des Magnesiumhydroxides. _cod_database_code 1010484
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formula: Ag2 O
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pub_title: Die Kristallstruktur einiger Oxyde I. _cod_database_code 1010486
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formula: Na F2 H
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formula_title: F2 H Na
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pub_title:
 Ueber feinbauliche Versuche zur Konstitution des Natriumhydrofluorids
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formula: Na Sb Al2
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pub_title: Ueber ein neues Mineral von Langban. _cod_database_code 1010488
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formula: C O2
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pub_title: Das Gitter des festen Kohlendioxyds. _cod_database_code 1010489
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formula: N
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pub_title: Das Gitter des Ammoniaks. _cod_database_code 1010490
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formula: B
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pub_title: Ueber die Gitterstruktur des Aethans und des Diborans. _cod_database_code 1010491
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formula: Ag3 P
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pub_title: Die Kristallstruktur von Silberphosphat und Silberarsenat (Ag3 XO4). _cod_database_code 1010493
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pub_title: Die Kristallstruktur von Silberphosphat und Silberarsenat (Ag3 XO4). _cod_database_code 1010494
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formula: Cl O
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pub_title: Das Gitter des Monohydrats des Li Cl (Li Cl+H2 O). _cod_database_code 1010495
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formula: (Mg1.8 Fe.2) Si O4
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pub_title: Die Struktur des Olivins. _cod_database_code 1010497
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formula_title: Hg N2
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pub_title:
 Roentgenographische Untersuchung des tetragonal kristallisierenden
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formula: Ca C2
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pub_title: Die Kristallstruktur des Calciumcarbides. _cod_database_code 1010500
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pub_title: Die Symmetrie und der Elementarbereich von Zinntetrajodid. _cod_database_code 1010501
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pub_title:
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 _cod_database_code 1010503

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formula: Cu3 Sb S3
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pub_title:
 Praezisionsmessungwn der Gitterkonstanten verschiedener Fahlerze.
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 _cod_database_code 1010508

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formula: K2 Pt Cl6
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pub_title: The Crystal Structure of Potassium Chloroplatinate. _cod_database_code 1010509
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formula: Nb N.5
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pub_title: Zur Frage der niederen Oxyde von Niob und ueber ein Niob-Subnitrid. _cod_database_code 1010510
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formula: Na Br O3
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pub_title: Die Lage der Atome in den optisch aktiven Kristallen NaClO3 und NaBrO3 _cod_database_code 1010511
formula_title: NaBrO3
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formula: Na Cl O3
compound: <missing>
pub_title: Die Lage der Atome in den optisch aktiven Kristallen NaClO3 und NaBrO3 _cod_database_code 1010512
formula_title: NaClO3
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c: 6.58
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formula: Al N
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pub_title: Das Gitter des Aluminiumnitrids (Al N) _cod_database_code 1010514
formula_title: Al N
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formula: Zr F7 N3
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formula_title: F7 H12 N3 Zr
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c: 9.35
alpha: 90
beta: 90
gamma: 90
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pub_title:
 Ueber die Struktur der isomorphen Verbindungen (N H4)3 Zr F7 und
 (N H4)3 Hf F7.
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formula: N O2
compound: <missing>
pub_title: Die Struktur von festem N2 O4 bei der Temperatur von fluessiger Luft. _cod_database_code 1010516
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formula: Po
compound: <missing>
pub_title: The Crystal Structure of Polonium by Electron Diffraction _cod_database_code 1010519
formula_title: Po
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b: 4.29
c: 14.1
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formula: Ge S2
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pub_title: The Crystal Structure of Germanium Disulphide _cod_database_code 1010520
formula_title: Ge S2
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b: 22.34
c: 6.86
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beta: 90
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formula: K B O2
compound: <missing>
pub_title: The Crystal Structure of Potassium Metaborate K3 (B3 O6) _cod_database_code 1010521
formula_title: B3 K3 O6
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formula: S Na2 O4
compound: <missing>
pub_title: The Crystal Structure of Sodium Sulfate III _cod_database_code 1010522
formula_title: Na2 O4 S
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formula: Na2 S O3
compound: <missing>
pub_title: The Crystal Lattice of Anhydrous Sodium Sulphite, Na2 S O3 _cod_database_code 1010523
formula_title: Na2 O3 S
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b: 5.441
c: 6.133
alpha: 90
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formula: K2 S2 O5
compound: <missing>
formula_title: K2 O5 S2
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b: 6.19
c: 7.55
alpha: 90
beta: 102.68
gamma: 90
cell_volume: 316.883
crystal_density: 2.330
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pub_title:
 The Crystal Lattice of Potassium Pyrosulphite,K2 S2 O5 and the
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formula: Na N O2
compound: <missing>
pub_title: The Crystal Structure of Sodium Nitrite, Na N O2 _cod_database_code 1010525
formula_title: N Na O2
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b: 5.56
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formula: Be O
compound: <missing>
pub_title: Ueber die Kristallstruktur von BeO _cod_database_code 1010526
formula_title: <missing>
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b: 2.694
c: 4.393
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beta: 90
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formula: Zn Te
compound: <missing>
pub_title: Die Kristallstruktur der Telluride von Zink, Cadmium und Quecksilber _cod_database_code 1010535
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formula: Cd Te
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pub_title: Die Kristallstruktur der Telluride von Zink, Cadmium und Quecksilber _cod_database_code 1010536
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formula: Hg Te
compound: <missing>
pub_title: Die Kristallstruktur der Telluride von Zink, Cadmium und Quecksilber _cod_database_code 1010537
formula_title: <missing>
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formula: Zn Te
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pub_title: Die Kristallstruktur der Telluride von Zink, Cadmium und Quecksilber _cod_database_code 1010538
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formula: Cd Te
compound: <missing>
pub_title: Die Kristallstruktur der Telluride von Zink, Cadmium und Quecksilber _cod_database_code 1010539
formula_title: Cd Te
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b: 6.41
c: 6.41
alpha: 90
beta: 90
gamma: 90
cell_volume: 263.375
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formula: Br N
compound: <missing>
formula_title: Br H4 N
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b: 6.007
c: 4.035
alpha: 90
beta: 90
gamma: 90
cell_volume: 145.599
crystal_density: 2.142
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pub_title:
 Crystal Structure of the Low Temperature Modification of Ammonium Bromide
 _cod_database_code 1010540

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formula: Al2 Be3 Si12 O24
compound: <missing>
pub_title: The structure of beryl, Be3Al2Si6O18 _cod_database_code 1010541
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formula: Ba S
compound: <missing>
pub_title: The Crystal Structures of Barytes, Celestine and Anglesite _cod_database_code 1010542
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b: 5.43
c: 7.13
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formula: Sr S
compound: <missing>
pub_title: The Crystal Structures of Barytes, Celestine and Anglesite _cod_database_code 1010543
formula_title: <missing>
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 Roentgenographische Strukturerforschung der kubischen Modifikation
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pub_title:
 Roentgenographische Strukturerforschung der kubischen Modifikation
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 Roentgenographische Strukturerforschung der kubischen Modifikation
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 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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formula: O4 Cl K
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formula: O4 Cl N
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formula: O3 K S
compound: <missing>
formula_title: K2 O6 S2
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b: 9.82
c: 6.36
alpha: 90
beta: 90
gamma: 120
cell_volume: 531.142
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pub_title:
 The structure of potassium dithionate K2 S2 O6 and the
 measurement of the integrated reflection from a small crystal
 _cod_database_code 1010613

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formula: S Be O8
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pub_title: Die Struktur des Berylliumsulfat-Tetrahydrates Be S O4 (H2 O)4 _cod_database_code 1010614
formula_title: Be H8 O8 S
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formula: Hg Br2
compound: <missing>
pub_title: Die Kristallstruktur des Quecksilberbromides _cod_database_code 1010615
formula_title: Br2 Hg
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b: 6.85
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formula: N F2
compound: <missing>
pub_title: The crystal structure of ammonium hydrogen fluoride N H4 H F2 _cod_database_code 1010616
formula_title: F2 H5 N
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b: 8.14
c: 3.68
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beta: 90
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formula: Zn Sb2
compound: <missing>
pub_title: The crystal structure of zinc meta-antimonate Zn (Sb O3)2 _cod_database_code 1010617
formula_title: O6 Sb2 Zn
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b: 6.585
c: 6.585
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formula: Pb Br2
compound: <missing>
pub_title: Die Kristallstruktur von Bleibromid Pb Br2 _cod_database_code 1010619
formula_title: Br2 Pb
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b: 8.02
c: 9.48
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beta: 90
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formula: Hg Cl2
compound: <missing>
pub_title: Die Kristallstruktur von Bleibromid Pb Br2 _cod_database_code 1010620
formula_title: Cl2 Hg
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b: 12.735
c: 4.423
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formula: N Cl
compound: <missing>
pub_title: Ricerche cristallografiche sui sali dell acido cloroso _cod_database_code 1010621
formula_title: Cl H4 N O2
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b: 6.3
c: 6.3
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gamma: 90
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formula: Mo O4 Ag2
compound: <missing>
pub_title: The crystal structure of silver molybdate _cod_database_code 1010623
formula_title: Ag2 Mo O4
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b: 9.26
c: 9.26
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beta: 90
gamma: 90
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formula: Na I
compound: <missing>
pub_title: The crystal structure of sodium periodate _cod_database_code 1010624
formula_title: I Na O4
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b: 5.322
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formula: K N C S
compound: <missing>
pub_title: The crystal structure of potassium thiocyanate _cod_database_code 1010625
formula_title: K N S
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c: 6.635
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formula: Ni N8 O6
compound: <missing>
pub_title: The composition and crystal structure of nickel nitrate hexammoniate _cod_database_code 1010626
formula_title: H18 N8 Ni O6
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b: 10.96
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formula: K2 Se Br6
compound: <missing>
pub_title: The crystal structure of potassium bromoselenite _cod_database_code 1010627
formula_title: Br6 K2 Se
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b: 10.363
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formula: Ag2 S O4 N4
compound: <missing>
pub_title: The crystal structure of silver sulfate tetrammoniate _cod_database_code 1010628
formula_title: Ag2 H12 N4 O4 S
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b: 8.43
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formula: Os O2 K2 Cl4
compound: <missing>
pub_title: The crystal structure of potassium osmyl chloride K2 Os O2 Cl4 _cod_database_code 1010629
formula_title: Cl4 K2 O2 Os
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c: 8.75
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formula: Si4 Cu15
compound: <missing>
pub_title: The crystal structure of a complex copper-silicon compound _cod_database_code 1010631
formula_title: Cu15 Si4
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b: 9.694
c: 9.694
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formula: N Cl I Br
compound: <missing>
pub_title: The crystal structure of Ammonium chlorobromoiodide _cod_database_code 1010632
formula_title: Br Cl H4 I N
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b: 8.58
c: 10.03
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formula: V Cu3 S4
compound: <missing>
pub_title: The crystal structure of CuVS4 _cod_database_code 1010634
formula_title: <missing>
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formula: Al5 C3 N
compound: <missing>
formula_title: Al5 N
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b: 3.28
c: 21.55
alpha: 90
beta: 90
gamma: 120
cell_volume: 200.782
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pub_title:
 Untersuchungen am Aluminiumcarbid Al4C3 und Aluminiumcarbonitrid Al5C3N
 _cod_database_code 1010635

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formula: Pt K2 Cl6
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pub_title: Raumgitter von Komplexsalzen _cod_database_code 1010636
formula_title: Cl6 K2 Pt
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b: 9.64
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formula: Pd Rb2 Br6
compound: <missing>
pub_title: Raumgitter von Komplexsalzen _cod_database_code 1010637
formula_title: Br6 Pd Rb2
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b: 10.02
c: 10.02
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beta: 90
gamma: 90
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crystal_density: 4.997
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atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
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pub_title:
 Gitterstruktur der Oxide, Sulfide, Selenide und Telluride des Lithiums,
 Natriums und Kaliums
 _cod_database_code 1010874

qdat:
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formula: Te Li2
compound: <missing>
formula_title: Li2 Te
a: 6.504
b: 6.504
c: 6.504
alpha: 90
beta: 90
gamma: 90
cell_volume: 275.132
crystal_density: 3.416
atoms_sites: ["Te1", "Li1"]
atoms_x: AAAAAEBCDwA=
atoms_y: AAAAAEBCDwA=
atoms_z: AAAAAEBCDwA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Gitterstruktur der Oxide, Sulfide, Selenide und Telluride des Lithiums,
 Natriums und Kaliums
 _cod_database_code 1010875

qdat:
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formula: O Na2
compound: <missing>
formula_title: Na2 O
a: 5.55
b: 5.55
c: 5.55
alpha: 90
beta: 90
gamma: 90
cell_volume: 170.954
crystal_density: 2.408
atoms_sites: ["O1", "Na1"]
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pub_title:
 Gitterstruktur der Oxide, Sulfide, Selenide und Telluride des Lithiums,
 Natriums und Kaliums
 _cod_database_code 1010876

qdat:
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formula: Te Na2
compound: <missing>
formula_title: Na2 Te
a: 7.314
b: 7.314
c: 7.314
alpha: 90
beta: 90
gamma: 90
cell_volume: 391.259
crystal_density: 2.947
atoms_sites: ["Te1", "Na1"]
atoms_x: AAAAAEBCDwA=
atoms_y: AAAAAEBCDwA=
atoms_z: AAAAAEBCDwA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
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atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
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pub_title:
 Gitterstruktur der Oxide, Sulfide, Selenide und Telluride des Lithiums,
 Natriums und Kaliums
 _cod_database_code 1010877

qdat:
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formula: O K2
compound: <missing>
formula_title: K2 O
a: 6.436
b: 6.436
c: 6.436
alpha: 90
beta: 90
gamma: 90
cell_volume: 266.593
crystal_density: 2.347
atoms_sites: ["O1", "K1"]
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atoms_z: AAAAAEBCDwA=
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pub_title:
 Gitterstruktur der Oxide, Sulfide, Selenide und Telluride des Lithiums,
 Natriums und Kaliums
 _cod_database_code 1010878

qdat:
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formula: Ca Se
compound: <missing>
pub_title: Die Gitterkonstanten von Ca O, Ca S, Ca Se, Ca Te. _cod_database_code 1010880
formula_title: Ca Se
a: 5.912
b: 5.912
c: 5.912
alpha: 90
beta: 90
gamma: 90
cell_volume: 206.635
crystal_density: 3.826
atoms_sites: ["Ca1", "Se1"]
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qdat:
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formula: Fe Cr2 S4
compound: Synthetic
formula_title: <missing>
a: 9.9763
b: 9.9763
c: 9.9763
alpha: 90
beta: 90
gamma: 90
cell_volume: 992.907
crystal_density: 3.855
atoms_sites: ["Fe", "Cr", "S"]
atoms_x: IKEHAICEHgBQ1w8A
atoms_y: IKEHAICEHgBQ1w8A
atoms_z: IKEHAICEHgBQ1w8A
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Fe", "Cr", "S"]
atoms_aniso_u11: GCQAAAgbAABAJAAA
atoms_aniso_u22: GCQAAAgbAABAJAAA
atoms_aniso_u33: GCQAAAgbAABAJAAA
atoms_aniso_u12: AAAAAGD////4/f//
atoms_aniso_u13: AAAAAGD////4/f//
atoms_aniso_u23: AAAAAGD////4/f//
pub_title:
 Experimental and theoretical charge density distribution of the colossal
 magnetoresistive transition metal sulfide FeCr2S4
 T = 23 K

qdat:
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formula: Pb2 Te O5
compound: Otto Mountain, Baker, California, USA
formula_title: <missing>
a: 7.5353
b: 5.7142
c: 10.8981
alpha: 90
beta: 91.330
gamma: 90
cell_volume: 469.126
crystal_density: 8.807
atoms_sites: ["Pb", "Te", "O1", "O2", "O3"]
atoms_x: CNQUAICEHgDg8iIAUGYcAEBCDwA=
atoms_y: kEwAAICEHgDQqTAA4IUXAAAvJgA=
atoms_z: SLIUAICEHgCQ9RoAUJYUAICEHgA=
atoms_occupancy: 0
atoms_u_iso: UMMAAHBiAAAgywAAwNoAAECcAAA=
atoms_aniso_label: ["Pb", "Te", "O1", "O2", "O3"]
atoms_aniso_u11: EIsAAEBRAABAnAAAAPoAAEAfAAA=
atoms_aniso_u22: YNEAANBrAAAAfQAAgDgBAECcAAA=
atoms_aniso_u33: gO0AANBrAAAgSAEAwF0AAKAJAQA=
atoms_aniso_u12: oA8AAOD8///A4P//oJL//wAAAAA=
atoms_aniso_u13: UPv//4AMAADA4P//AAAAAEAfAAA=
atoms_aniso_u23: wBIAAPAKAABAnAAAINH//wAAAAA=
pub_title:
 Lead-tellurium oxysalts from Otto Mountain near Baker, California:
 I. Ottoite, Pb2TeO5, a new mineral with chains of tellurate octahedra

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.694
b: 4.694
c: 15.43
alpha: 90
beta: 90
gamma: 120
cell_volume: 294.430
crystal_density: 3.920
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAQwRAA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
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atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P0, P = 0.02 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.676
b: 4.676
c: 15.310
alpha: 90
beta: 90
gamma: 120
cell_volume: 289.904
crystal_density: 3.982
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADQuhAA
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P1, P = 1.89 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.664
b: 4.664
c: 15.168
alpha: 90
beta: 90
gamma: 120
cell_volume: 285.743
crystal_density: 4.040
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAACgqRAA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P2, P = 3.48 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.650
b: 4.650
c: 15.12
alpha: 90
beta: 90
gamma: 120
cell_volume: 283.132
crystal_density: 4.077
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADgyBAA
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P3, P = 4.89 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.637
b: 4.637
c: 14.98
alpha: 90
beta: 90
gamma: 120
cell_volume: 278.944
crystal_density: 4.138
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADA9xAA
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P4, P = 7.31 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.607
b: 4.607
c: 14.415
alpha: 90
beta: 90
gamma: 120
cell_volume: 264.961
crystal_density: 4.357
atoms_sites: ["Fe", "C", "O"]
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atoms_aniso_u13: 0
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pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P5, P = 14.4 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.587
b: 4.587
c: 14.258
alpha: 90
beta: 90
gamma: 120
cell_volume: 259.805
crystal_density: 4.443
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAw9hAA
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P6, P = 18.37 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.575
b: 4.575
c: 14.29
alpha: 90
beta: 90
gamma: 120
cell_volume: 259.027
crystal_density: 4.456
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAQ8xAA
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atoms_aniso_u13: 0
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pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P7, P = 18.82 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.579
b: 4.579
c: 14.28
alpha: 90
beta: 90
gamma: 120
cell_volume: 259.299
crystal_density: 4.452
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAw9hAA
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P8, P = 19.19 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.548
b: 4.548
c: 13.89
alpha: 90
beta: 90
gamma: 120
cell_volume: 248.813
crystal_density: 4.639
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAACwAhEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
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atoms_aniso_u22: 0
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P9, P = 28.62 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.539
b: 4.539
c: 13.80
alpha: 90
beta: 90
gamma: 120
cell_volume: 246.224
crystal_density: 4.688
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAwDxEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
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atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P10, P = 30.6 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.527
b: 4.527
c: 13.57
alpha: 90
beta: 90
gamma: 120
cell_volume: 240.842
crystal_density: 4.793
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAABABBEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: oIwAACBOAADgqwAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P11, P = 36.3 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.519
b: 4.519
c: 13.47
alpha: 90
beta: 90
gamma: 120
cell_volume: 238.223
crystal_density: 4.845
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAw9hAA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: IJkAACBOAADgqwAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P12, P = 38.5 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.523
b: 4.523
c: 13.40
alpha: 90
beta: 90
gamma: 120
cell_volume: 237.404
crystal_density: 4.862
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAAFxEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: oIwAACBOAACgjAAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P13-1, P = 39.05 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.518
b: 4.518
c: 13.457
alpha: 90
beta: 90
gamma: 120
cell_volume: 237.887
crystal_density: 4.852
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADA9xAA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: oKUAACBOAADgqwAA
atoms_aniso_label: "<missing>"
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P13-2, P = 39.0 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.514
b: 4.514
c: 13.34
alpha: 90
beta: 90
gamma: 120
cell_volume: 235.402
crystal_density: 4.904
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADA9xAA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: gIkAACBOAABAnAAA
atoms_aniso_label: "<missing>"
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P14, P = 41.2 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.502
b: 4.502
c: 13.23
alpha: 90
beta: 90
gamma: 120
cell_volume: 232.221
crystal_density: 4.971
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAABABBEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: MI4AACBOAACAuwAA
atoms_aniso_label: "<missing>"
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atoms_aniso_u22: 0
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P15, P = 43.9 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.500
b: 4.500
c: 13.25
alpha: 90
beta: 90
gamma: 120
cell_volume: 232.365
crystal_density: 4.968
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAAFxEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: YG0AACBOAAAgTgAA
atoms_aniso_label: "<missing>"
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atoms_aniso_u22: 0
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P16, P = 44.14 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.485
b: 4.485
c: 13.19
alpha: 90
beta: 90
gamma: 120
cell_volume: 229.774
crystal_density: 5.024
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAwKBEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: sLMAACBOAACgjAAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P18_HS, P = 45.13 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.367
b: 4.367
c: 12.78
alpha: 90
beta: 90
gamma: 120
cell_volume: 211.071
crystal_density: 5.469
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAABAmhEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: MFwAACBOAACgWgAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
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atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P19, P = 46.4 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.372
b: 4.372
c: 12.72
alpha: 90
beta: 90
gamma: 120
cell_volume: 210.561
crystal_density: 5.482
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADAphEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: oHMAACBOAAAAfQAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P20-1, P = 46.92 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.368
b: 4.368
c: 12.75
alpha: 90
beta: 90
gamma: 120
cell_volume: 210.672
crystal_density: 5.479
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAwjBEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: EEAAACBOAACwTwAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P20-2, P = 47.2 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.367
b: 4.367
c: 12.74
alpha: 90
beta: 90
gamma: 120
cell_volume: 210.410
crystal_density: 5.486
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADQmxEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: 0FIAACBOAACgWgAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P21, P = 47.49 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.364
b: 4.364
c: 12.66
alpha: 90
beta: 90
gamma: 120
cell_volume: 208.802
crystal_density: 5.528
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAACwmBEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: 8FUAACBOAABgbQAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P22, P = 49.2 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.355
b: 4.355
c: 12.59
alpha: 90
beta: 90
gamma: 120
cell_volume: 206.791
crystal_density: 5.582
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAACgoxEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: AGQAACBOAACAPgAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P23, P = 51.9 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.358
b: 4.358
c: 12.62
alpha: 90
beta: 90
gamma: 120
cell_volume: 207.570
crystal_density: 5.561
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADQtBEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: YG0AACBOAAAAfQAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P24, P = 52.6 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.355
b: 4.355
c: 12.54
alpha: 90
beta: 90
gamma: 120
cell_volume: 205.970
crystal_density: 5.604
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAgsBEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: MHUAACBOAACgjAAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P25, P = 54.0 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.343
b: 4.343
c: 12.497
alpha: 90
beta: 90
gamma: 120
cell_volume: 204.134
crystal_density: 5.655
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADQtBEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: 0FIAACBOAABwSQAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P26, P = 55.96 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.3474
b: 4.3474
c: 12.534
alpha: 90
beta: 90
gamma: 120
cell_volume: 205.154
crystal_density: 5.627
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAADwnhEA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: QJwAACBOAADgqwAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P27-1, P = 55.0 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.3462
b: 4.3462
c: 12.519
alpha: 90
beta: 90
gamma: 120
cell_volume: 204.795
crystal_density: 5.636
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAACAuREA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: 4HkAACBOAACgjAAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P27-2, P = 55.0 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.3480
b: 4.3480
c: 12.52
alpha: 90
beta: 90
gamma: 120
cell_volume: 204.981
crystal_density: 5.631
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAABgnREA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: AJYAACBOAABQkQAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P27-3, P = 55.0 GPa

qdat:
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formula: Fe C O3
compound: Invigtut, Greenland
formula_title: <missing>
a: 4.347
b: 4.347
c: 12.477
alpha: 90
beta: 90
gamma: 120
cell_volume: 204.183
crystal_density: 5.653
atoms_sites: ["Fe", "C", "O"]
atoms_x: AAAAAAAAAAAArREA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: YG0AACBOAACgjAAA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P27-4, P = 55.0 GPa

qdat:
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formula: Ca C O3
compound: Jachymov, Bohemia, Czech Republic
pub_title: Primary minerals of the Jachymov ore district
formula_title: <missing>
a: 4.9844
b: 4.9844
c: 17.0376
alpha: 90
beta: 90
gamma: 120
cell_volume: 366.577
crystal_density: 2.720
atoms_sites: ["Ca", "C", "O"]
atoms_x: AAAAAAAAAABA2A8A
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8A
atoms_occupancy: 0
atoms_u_iso: SBoCAGAWAgBowgIA
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAEABAAAAAgAABAAAAgAAAJBAAAAAAAAEIgACkAQBAAAAIIABEAAgAgCJABBCAAAAFAAaAAAAAlADAQQCARACQAAAAoBQAgIEgDIgAAagWEAABICAEACkCRECCACgAAVAogABA==


formula: Ni.97 Co.01 As S.02
compound: Jachymov, Bohemia, Czech Republic
pub_title: Primary minerals of the Jachymov ore district Sample MP511
formula_title: <missing>
a: 3.6190
b: 3.6190
c: 5.036
alpha: 90
beta: 90
gamma: 120
cell_volume: 57.121
crystal_density: 7.738
atoms_sites: ["Ni", "Co", "As", "S"]
atoms_x: AAAAAAAAAABVWBQAVVgUAA==
atoms_y: AAAAAAAAAACrsCgAq7AoAA==
atoms_z: AAAAAAAAAABAQg8AQEIPAA==
atoms_occupancy: QDQ7AECcAAAACT0AgDgBAA==
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAIAAAAAAAAAAAAAIAAABAAAAAAAABAAAhAAAAAAACAAAAQAAAAICBIAAAAACAAIIAAAACAQQAAAAABAAAAEIIEAAAEAQIAACAKEAAAgEEAACIUAIAEBQAAAEEQQAAAAA==


formula: Zn.9 Fe.11 S.99
compound: Jachymov, Bohemia, Czech Republic
pub_title: Primary minerals of the Jachymov ore district Sample J1215P
formula_title: <missing>
a: 5.4174
b: 5.4174
c: 5.4174
alpha: 90
beta: 90
gamma: 90
cell_volume: 158.991
crystal_density: 4.041
atoms_sites: ["Zn", "Fe", "S"]
atoms_x: AAAAAAAAAABAQg8A
atoms_y: AAAAAAAAAABAQg8A
atoms_z: AAAAAAAAAABAQg8A
atoms_occupancy: gO42AMC2BgDAbDwA
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAACAAAAAAAAAAAAAAACAAAAAAAAAQAAgAAAAAAAAAIAAAAAAQAEAAAAAAACAAAAAEAAAAAAAAIAAAAIAgAAAAAIAAABAQAAAAAgAAAgEAAAACAAAEAAAAACAAAQIAAAAgA==


formula: (Y Ca2) Sb Fe4 O12
compound: Synthetic
pub_title: Magnetic ordering in the garnet YCa2SbFe4O12 T = 10 K
formula_title: YCa2SbFe4O12
a: 12.521
b: 12.521
c: 12.521
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beta: 90
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pub_title:
 Soluzioni solide, isomorfismo e simmorfismo tra gli ossidi dei metalli
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pub_title:
 Soluzioni solide, isomorfismo e simmorfismo tra gli ossidi dei metalli
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 Die Krystallstruktur des Ammonium-, Kalium-, Rubidium- und
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 Die Krystallstruktur des Ammonium-, Kalium-, Rubidium- und
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formula: Li H
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pub_title:
 Ueber die Steinsalzstruktur der Verbindung Li2 Ti O3 und ihre
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formula: Mn O
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formula: Sr Cl2
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formula_title: Cs I O3
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pub_title:
 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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pub_title:
 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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pub_title:
 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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formula: K S
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pub_title: Zur Kenntnis der Hydrosulfide und Hydroselenide der Alkalimetalle _cod_database_code 1010904
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formula: Rb S
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pub_title: Zur Kenntnis der Hydrosulfide und Hydroselenide der Alkalimetalle _cod_database_code 1010905
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formula: Cs S
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pub_title: Zur Kenntnis der Hydrosulfide und Hydroselenide der Alkalimetalle _cod_database_code 1010906
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pub_title: Zur Kenntnis der Hydrosulfide und Hydroselenide der Alkalimetalle _cod_database_code 1010907
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formula: K Se
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pub_title: Zur Kenntnis der Hydrosulfide und Hydroselenide der Alkalimetalle _cod_database_code 1010908
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pub_title: Zur Kenntnis der Hydrosulfide und Hydroselenide der Alkalimetalle _cod_database_code 1010909
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formula: Cs Se
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pub_title: Zur Kenntnis der Hydrosulfide und Hydroselenide der Alkalimetalle _cod_database_code 1010910
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pub_title: Die Kristallstruktur des Berzeliit (Ca, Na)3 (Mg, Mn)2 (As O4)3 _cod_database_code 1010911
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formula: Zr O2
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pub_title: Zur Struktur des Baddeleyits Zr O2 _cod_database_code 1010912
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formula: Fe Nb2 O6
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pub_title: The Crystal Structure of Columbite _cod_database_code 1010915
formula_title: <missing>
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c: 5.73
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formula: Ca5 P3 O12 Cl
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formula_title: <missing>
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beta: 90
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pub_title:
 The Crystal Structures of Some Natural and Synthetic Apatite-Like
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formula: Ca4 S2 O9
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pub_title: Ricerche sul solfato di calcio semidrato e sull'anidrite solubile _cod_database_code 1010918
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formula: Cu S
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pub_title: The Crystal Structure of Covellite _cod_database_code 1010920
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formula: Si O2
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pub_title: The Cristobalite Structures. I. High-Cristobalite _cod_database_code 1010921
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formula: O5 Si Al2
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pub_title: The Structure of Andalusite, Al2 Si O5 _cod_database_code 1010924
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pub_title: Ueber die Struktur von Adamin. _cod_database_code 1010925
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pub_title:
 The crystal structure of the modification C of the sesquioxides of the
 rare earth metals, and of indium and thallium.
 _cod_database_code 1010927

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 Zur Kristallstruktur von Anastas und Rutil. (II. Teil. Die
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pub_title: Die Struktur des Tiemannit und Koloradoit. _cod_database_code 1010945
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pub_title: Die Kristallstruktur von Kryolithionit. _cod_database_code 1010947
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 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
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 Silicate structures of the cristobalite type: III. Structural
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 _cod_database_code 1010953

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formula: Si O2
compound: <missing>
formula_title: <missing>
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b: 7.12
c: 7.12
alpha: 90
beta: 90
gamma: 90
cell_volume: 360.944
crystal_density: 2.211
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pub_title:
 The crystal structure of the high temperature form of Cristobalite (SiO2)
 _cod_database_code 1010954

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formula: Cu S
compound: Sardinia, Italy
pub_title: Die Kristallstruktur des Covellins CuS
formula_title: <missing>
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b: 3.8
c: 16.39999
alpha: 90
beta: 90
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formula: Pb C O2
compound: <missing>
pub_title: The crystal structure of Cerussite _cod_database_code 1010956
formula_title: <missing>
a: 5.166
b: 8.468
c: 6.146
alpha: 90
beta: 90
gamma: 90
cell_volume: 268.861
crystal_density: 12.412
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formula: Na Al Si O4
compound: <missing>
formula_title: <missing>
a: 7.37
b: 7.37
c: 7.37
alpha: 90
beta: 90
gamma: 90
cell_volume: 400.316
crystal_density: 2.357
atoms_sites: ["Na1", "Al1", "Si1", "O1", "O2"]
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pub_title:
 Silicate structures of the cristobalite type. The crystal structure of
 alpha-carnegieite (Na Al Si O4)
 _cod_database_code 1010957

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formula: Ba Si3 O9 Ti
compound: <missing>
pub_title: The crystal structure of Benitoite Ba Ti Si3 O9 _cod_database_code 1010959
formula_title: <missing>
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b: 6.60
c: 9.71
alpha: 90
beta: 90
gamma: 120
cell_volume: 366.301
crystal_density: 3.749
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formula: Au Sb2
compound: Synthetic
formula_title: <missing>
a: 6.6583
b: 6.6583
c: 6.6583
alpha: 90
beta: 90
gamma: 90
cell_volume: 295.182
crystal_density: 9.911
atoms_sites: ["Au", "Sb"]
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pub_title:
 On the solid solubility and structural properties of PdAs2-xSbx,
 PtP2-xAsx, PtP2-xSbx, PtP2-xBix, PtAs2-xSbx, PtAs2-xBix, PtSb2-xBix,
 Pdl-mPtmAs2, Pdl-mPtmSb2, Pdl-mAumSb2, and Ptl-mAumSb2

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formula_title: PdAs2
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b: 5.9855
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beta: 90
gamma: 90
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pub_title:
 On the solid solubility and structural properties of PdAs2-xSbx,
 PtP2-xAsx, PtP2-xSbx, PtP2-xBix, PtAs2-xSbx, PtAs2-xBix, PtSb2-xBix,
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formula: Pd Sb2
compound: Synthetic
formula_title: PdSb2
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b: 6.4584
c: 6.4584
alpha: 90
beta: 90
gamma: 90
cell_volume: 269.386
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pub_title:
 On the solid solubility and structural properties of PdAs2-xSbx,
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formula: (Al.32 Si.68) O2
compound: <missing>
pub_title: Crystal structure of chabazite, a molecular sieve Note: extra-framework cations not located
formula_title: <missing>
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b: 9.4
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beta: 94.3
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compound: Valmozzola, Parma, Italy
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pub_title:
 Crystal chemistry and low-temperature behavior of datolite:
 a single-crystal X-ray diffraction study

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pub_title:
 Crystal chemistry and low-temperature behavior of datolite:
 a single-crystal X-ray diffraction study

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pub_title:
 Crystal chemistry and low-temperature behavior of datolite:
 a single-crystal X-ray diffraction study

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pub_title:
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pub_title:
 Uber die Kristallstrukturen der verbindungen RuS2, OsS2, MnTe2 und AuSb2.
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pub_title:
 Uber die Kristallstrukturen der verbindungen RuS2, OsS2, MnTe2 und AuSb2.
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pub_title: Crystal chemistry of murunskite
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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
 Note: P = 0.001 kbar

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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
 Note: P = 15.4 kbar

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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
 Note: P = 31.4 kbar

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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
 Note: P = 41.6 kbar

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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
 Note: P = 43.9 kbar

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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
 Note: P = 52.4 kbar

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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
 Note: P = 0.001 kbar

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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
 Note: P = 40.6 kbar

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 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
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pub_title:
 Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars
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 Lead-tellurium oxysalts from Otto Mountain near Baker, California:
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 The effect of oxygen vacancies and aluminium substitution on the
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 The effect of oxygen vacancies and aluminium substitution on the
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 The effect of oxygen vacancies and aluminium substitution on the
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 The effect of oxygen vacancies and aluminium substitution on the
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 The effect of oxygen vacancies and aluminium substitution on the
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