# cif

formula: (Ta3 Nb.5 Ti.5) Pb K.5 Na1.5 As4 O18
compound: <missing>
formula_title: <missing>
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b: 15.287
c: 8.684
alpha: 90
beta: 90
gamma: 90
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crystal_density: 5.974
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pub_title:
 Zimbabweite, Na(Pb,Na,K)2As4(Ta,Nb,Ti)4O18, an arsenite-tantalate with a
 novel corner-linked octahedral sheet

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formula: Mg1.948 Ca.052 Si2 O6
compound: <missing>
pub_title: Stability of orthoenstatite at high temperature and low pressure
formula_title: <missing>
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b: 8.834
c: 5.197
alpha: 90
beta: 90
gamma: 90
cell_volume: 839.240
crystal_density: 3.191
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formula: Ca1.799 Sr.201 Al1.869 Mn.808 Fe.323 Si3 O13 H
compound: <missing>
pub_title: Thermal behavior of the crystal structure of strontian piemontite Sample: T = 25 C
formula_title: <missing>
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b: 5.684
c: 10.202
alpha: 90
beta: 115.23
gamma: 90
cell_volume: 466.022
crystal_density: 3.533
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formula: Ca1.799 Sr.201 Al1.869 Mn.808 Fe.323 Si3 O13 H
compound: <missing>
pub_title: Thermal behavior of the crystal structure of strontian piemontite Sample: T = 800 C
formula_title: <missing>
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c: 10.30
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formula: Mn3 Zn O10 H6
compound: Bisbee, Arizona
formula_title: <missing>
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b: 7.533
c: 20.794
alpha: 90
beta: 90
gamma: 120
cell_volume: 1021.891
crystal_density: 3.863
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pub_title:
 Chalcophanite, ZnMn3O7.3(H2O): New crystal-structure determinations
 Note: U(1,2) of O3 altered to match symmetry constraints
 Note: H positions determined by energy modelling

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formula: Mn3 Zn O10 H6
compound: Sterling Hill, New Jersey
formula_title: <missing>
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b: 7.541
c: 20.824
alpha: 90
beta: 90
gamma: 120
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pub_title:
 Chalcophanite, ZnMn3O7.3(H2O): New crystal-structure determinations
 Note: U(1,2) of O3 altered to match symmetry constraints

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formula: Mn5 As2 O16 H12
compound: <missing>
pub_title: Akrochordite, (Mn,Mg)5(OH)4(H2O)4(AsO4)2: A sheet structure with amphibole walls
formula_title: <missing>
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b: 17.627
c: 6.832
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formula: Si3 Fe2 Ca3 O12
compound: <missing>
formula_title: <missing>
a: 12.031
b: 12.031
c: 12.031
alpha: 90
beta: 90
gamma: 90
cell_volume: 1741.427
crystal_density: 3.877
atoms_sites: ["Si", "Fe", "Ca", "O"]
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pub_title:
 High-pressure crystal chemistry of andradite and pyrope: Revised procedures for
 high-pressure diffraction experiments
 sample in air

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formula: Si3 Fe2 Ca3 O12
compound: <missing>
formula_title: <missing>
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b: 11.992
c: 11.992
alpha: 90
beta: 90
gamma: 90
cell_volume: 1724.546
crystal_density: 3.915
atoms_sites: ["Si", "Fe", "Ca", "O"]
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pub_title:
 High-pressure crystal chemistry of andradite and pyrope: Revised procedures for
 high-pressure diffraction experiments
 P = 2.0 GPa

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formula: Si3 Fe2 Ca3 O12
compound: <missing>
formula_title: <missing>
a: 11.9546
b: 11.9546
c: 11.9546
alpha: 90
beta: 90
gamma: 90
cell_volume: 1708.462
crystal_density: 3.951
atoms_sites: ["Si", "Fe", "Ca", "O"]
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pub_title:
 High-pressure crystal chemistry of andradite and pyrope: Revised procedures for
 high-pressure diffraction experiments
 P = 3.0 GPa

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formula: Si3 Fe2 Ca3 O12
compound: <missing>
formula_title: <missing>
a: 11.915
b: 11.915
c: 11.915
alpha: 90
beta: 90
gamma: 90
cell_volume: 1691.539
crystal_density: 3.991
atoms_sites: ["Si", "Fe", "Ca", "O"]
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pub_title:
 High-pressure crystal chemistry of andradite and pyrope: Revised procedures for
 high-pressure diffraction experiments
 P = 5.0 GPa

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formula: Si3 Fe2 Ca3 O12
compound: <missing>
formula_title: <missing>
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beta: 90
gamma: 90
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 High-pressure crystal chemistry of andradite and pyrope: Revised procedures for
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 High-pressure crystal chemistry of andradite and pyrope: Revised procedures for
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 High-pressure crystal chemistry of andradite and pyrope: Revised procedures for
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 High-pressure crystal chemistry of andradite and pyrope: Revised procedures for
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pub_title:
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pub_title:
 Cation ordering in Ni-Mg olivines
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pub_title:
 Cation ordering in Ni-Mg olivines
 sample Ni.63, heated to 1150 C, then quenched
 Mg.634Ni1.363SiO4

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formula_title: <missing>
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pub_title:
 Cation ordering in Ni-Mg olivines
 sample Ni.75, synthesized at 910 C, then quenched
 Mg.505Ni1.492SiO4

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pub_title:
 Cation ordering in Ni-Mg olivines
 sample Ni.75, heated to 1150 C, then quenched
 Mg.505Ni1.492SiO4

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compound: Jack Creek deposit, near Basin, Montana, USA
pub_title: Crystal chemistry of alkali-deficient schorl and tourmaline structural relationships
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formula: Fe1.473 P O5 H
compound: <missing>
pub_title: Crystal structure of synthetic lipscombite: A redetermination
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formula: Mg4 Si4 O12
compound: <missing>
formula_title: MgSiO3
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b: 11.501
c: 11.480
alpha: 90
beta: 90
gamma: 90
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pub_title:
 Structure and twinning of single-crystal MgSiO3 garnet synthesized at 17 GPa and 1800 C
 Note: majoritic or majorite-like

atoms_sites:
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pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le4A, natural

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pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le4A, 1050 C, 3 min

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pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le4A, 1050 C, 10 min

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pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le4A, 1050 C, 90 min

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compound: <missing>
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gamma: 90
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atoms_aniso_u23: kAEAAJABAABQ+///UPv//wAAAAAgAwAA4Pz//0AGAABA1P//YAkAAGAiAACgxP//
pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le4A, 1150 C, 2 min

qdat:
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formula: (Mg.893 Fe.106) Si O3
compound: <missing>
formula_title: <missing>
a: 18.242
b: 8.803
c: 5.198
alpha: 90
beta: 90
gamma: 90
cell_volume: 834.717
crystal_density: 3.302
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: 4O8WAODvFgCAGBcAgBgXAKCQEABw5hwAYCsLALD2EgAgeBIA4FwiADBvGgBgSBsA
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atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
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atoms_aniso_u23: kAEAAJABAADg/P//4Pz//3D+///QBwAAIAMAAOD8///w2P//sAQAABAnAAAAtf//
pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le4A, 1150 C, 10 min

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formula: (Mg.915 Fe.085) Si O3
compound: <missing>
formula_title: <missing>
a: 18.246
b: 8.828
c: 5.189
alpha: 90
beta: 90
gamma: 90
cell_volume: 835.822
crystal_density: 3.276
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: 4O8WAODvFgBwChcAcAoXADCSEAAA6BwAEDALAGD7EgBAexIAEFUiADBvGgDAURsA
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pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le9A, natural

qdat:
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formula: (Mg.916 Fe.084) Si O3
compound: <missing>
formula_title: <missing>
a: 18.250
b: 8.830
c: 5.190
alpha: 90
beta: 90
gamma: 90
cell_volume: 836.355
crystal_density: 3.273
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: 4O8WAODvFgBwChcAcAoXADCSEAAA6BwAEDALAND5EgBAexIAEFUiADBvGgAQTRsA
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atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
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atoms_aniso_u23: sAQAALAEAAAAAAAAAAAAAAAAAACQAQAA8AoAAFD7//9Q4v//cP7//6APAAAQ3P//
pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le9A, 1050 C, 3 min

qdat:
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formula: (Mg.914 Fe.086) Si O3
compound: <missing>
formula_title: <missing>
a: 18.250
b: 8.829
c: 5.191
alpha: 90
beta: 90
gamma: 90
cell_volume: 836.422
crystal_density: 3.274
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: cPEWAHDxFgBwChcAcAoXAMCTEAAA6BwAoDELAND5EgDQfBIAEFUiADBvGgCgThsA
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atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
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atoms_aniso_u12: cP7//3D+//8g6v//IOr//xD1//+QAQAAcP7//+Dj//8AAAAAIAMAAAAZAABQ+///
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atoms_aniso_u23: sAQAALAEAADg/P//4Pz//3D+//+QAQAAMPj//4AMAADA4P//YAkAABAOAABQ4v//
pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le9A, 1050 C, 10 min

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formula: (Mg.914 Fe.086) Si O3
compound: <missing>
formula_title: <missing>
a: 18.248
b: 8.831
c: 5.189
alpha: 90
beta: 90
gamma: 90
cell_volume: 836.197
crystal_density: 3.275
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: 4O8WAODvFgBwChcAcAoXAMCTEAAA6BwAoDELAND5EgBAexIAEFUiAKBtGgAQTRsA
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atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
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atoms_aniso_u13: EPX//xD1//9Q4v//UOL//7AEAAAw+P//AAAAAPDx//+g9v//4Pz//zD4///g/P//
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAHD+//+QAQAA4Pz//4AMAADg4///IAMAAOAVAAAw3///
pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le9A, 1050 C, 90 min

qdat:
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formula: (Mg.913 Fe.087) Si O3
compound: <missing>
formula_title: <missing>
a: 18.248
b: 8.832
c: 5.192
alpha: 90
beta: 90
gamma: 90
cell_volume: 836.776
crystal_density: 3.275
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: 4O8WAODvFgBwChcAcAoXAMCTEAAA6BwAEDALAND5EgDQfBIAEFUiADBvGgAQTRsA
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atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
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pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le9A, 1150 C, 2 min

qdat:
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formula: (Mg.914 Fe.086) Si O3
compound: <missing>
formula_title: <missing>
a: 18.243
b: 8.834
c: 5.190
alpha: 90
beta: 90
gamma: 90
cell_volume: 836.413
crystal_density: 3.275
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: 4O8WAODvFgBwChcAcAoXAMCTEAAA6BwAEDALAND5EgDQfBIAgFMiADBvGgAwUBsA
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atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_aniso_u11: AH0AAAB9AADgqwAA4KsAAHBiAADgYAAAUF8AAHCUAADQhAAAAGQAABCLAADgeQAA
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atoms_aniso_u12: AAAAAAAAAAAA5///AOf//6D2//9w/v//sAQAACDq///A+f//wPn//3AXAABQ+///
atoms_aniso_u13: EPX//xD1///A4P//wOD//7AEAABQ+///MBEAALDr//+QAQAAAAAAAJABAABw/v//
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pub_title:
 Crystal-chemical study of cation disordering in Al-rich and Al-poor
 orthopyroxenes from spinel lherzolite xenoliths
 sample Le9A, 1150 C, 10 min

qdat:
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formula: Mg.712 Cr.306 Si.982 O3
compound: <missing>
pub_title: Crystal structure of a Cr-bearing pyroxene Sample: Mg1.4Cr.6Si2O6
formula_title: <missing>
a: 9.713
b: 8.910
c: 5.238
alpha: 90
beta: 109.41
gamma: 90
cell_volume: 427.547
crystal_density: 3.380
atoms_sites: ["Mg1", "Cr1", "Mg2", "Cr2", "SiA", "CrA", "SiB", "CrB", "O1A", "O2A", "O3A", "O1B", "O2B", "O3B"]
atoms_x: oEsPAKBLDwAAbg8AAG4PAIDIAgCAyAIA0IYhANCGIQBgEDUAoHsHAECqBgDgvRYAkJQmANC/JAA=
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atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Cr1", "Mg2", "Cr2", "SiA", "CrA", "SiB", "CrB", "O1A", "O2A", "O3A", "O1B", "O2B", "O3B"]
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atoms_aniso_u23: 0BsAANAbAAAIBwAACAcAAHADAABwAwAACAcAAAgHAADYIgAAKN3//+ApAAAAAAAAKN3//1AtAAA=
qdat:
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formula: Fe.581 Mg.233 Zn.163 Ti.022 Al4.499 Si1.804 Mn.02 O12 H
compound: <missing>
pub_title: Iron distribution in staurolite at room and low temperatures sample at room temperature
formula_title: <missing>
a: 7.865
b: 16.580
c: 5.668
alpha: 90
beta: 90.38
gamma: 90
cell_volume: 739.101
crystal_density: 3.738
atoms_sites:
["Fe", "Mg", "Zn", "Ti", "Al", "Si", "Al", "Al1A", "Al1B", "Al2", "Al3A", "Fe3A", "Al3B", "Fe3B", "Mn1", "Fe1", "Mn2", "Fe2", "O1A", "O-H1B", "O2A", "O2B", "O3", "O4", "O5"]

atoms_x:
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atoms_y:
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atoms_z:
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atoms_occupancy:
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formula_title: <missing>
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alpha: 90
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cell_volume: 739.062
crystal_density: 3.738
pub_title:
 Iron distribution in staurolite at room and low temperatures
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compound: <missing>
formula_title: <missing>
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cell_volume: 1480.655
crystal_density: 3.321
atoms_u_iso: 0
pub_title:
 Kornerupine: Chemical crystallography, comparative crystallography, and its
 cation relation to olivine and to Ni2In intermetallic

atoms_sites:
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compound: <missing>
pub_title: Geigerite, the Mn analogue of chudobaite: Its description and crystal structure
formula_title: <missing>
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compound: <missing>
pub_title: Effects of oxidation-dehydrogenation in tschermakitic hornblende sample H-1, natural
formula_title: <missing>
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c: 5.321
alpha: 90
beta: 104.97
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cell_volume: 910.746
crystal_density: 3.207
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alpha: 90
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cell_volume: 907.657
crystal_density: 3.225
pub_title:
 Effects of oxidation-dehydrogenation in tschermakitic hornblende
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atoms_sites:
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cell_volume: 903.616
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pub_title:
 Effects of oxidation-dehydrogenation in tschermakitic hornblende
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atoms_sites:
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 OH substitution in garnets: X-ray and neutron diffraction, infrared, and
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pub_title:
 Cation distribution in the octahedral sites of hornblendes
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pub_title: Cation distribution in the octahedral sites of hornblendes sample O-H from Obira, Japan
formula_title: <missing>
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compound: <missing>
pub_title: Cation distribution in the octahedral sites of hornblendes sample P-P from Parau Island
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compound: <missing>
pub_title: Cation distribution in the octahedral sites of hornblendes sample K-H from Kawanabe, Japan
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formula: Ca.997 Fe.234 Mg.769 C2 O6
compound: <missing>
formula_title: <missing>
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pub_title:
 Structural variation in the dolomite-ankerite solid-solution series: An X-ray,
 Mossbauer, and TEM study
 sample BM 1931-294

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compound: <missing>
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pub_title:
 Structural variation in the dolomite-ankerite solid-solution series: An X-ray,
 Mossbauer, and TEM study
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pub_title:
 Structural variation in the dolomite-ankerite solid-solution series: An X-ray,
 Mossbauer, and TEM study
 sample AMNH 8059

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formula: Ir Sb S
compound: <missing>
pub_title: Crystal chemistry and crystallography of some minerals within the pyrite group
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formula: (Cu.7 Fe.3) S2
compound: <missing>
pub_title: Crystal chemistry and crystallography of some minerals within the pyrite group
formula_title: <missing>
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cell_volume: 174.209
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formula: (Pt.73 Pd.27) (Bi1.3 Te.63 Sb.07)
compound: <missing>
pub_title: Crystal chemistry and crystallography of some minerals within the pyrite group
formula_title: <missing>
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cell_volume: 299.016
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formula: Cu9.36 Zn Ge1.62 Fe3.56 S16
compound: <missing>
pub_title: Renierite crystal structure refined from Rietveld analysis of powder neutron-diffrection data
formula_title: <missing>
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b: 10.6226
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beta: 90
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formula: Pb1.002 Fe12 O19
compound: <missing>
formula_title: <missing>
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b: 5.873
c: 23.007
alpha: 90
beta: 90
gamma: 120
cell_volume: 687.243
crystal_density: 5.711
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pub_title:
 Magnetoplumbite, PbFe12O19: Refinement and lone-pair splitting
 Note: Symmetry constraints on U(i,j) for Fe5, O4  and O5 were incorrect,
 and likely were refined wrong.
 They have been replaced with their isotropic equivalents.

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formula: Ca1.374 Li2.9 K.3 Na.048 P6 Be6 O33.5 H19
compound: Tip Top mine, Custer, South Dakota, USA
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pub_title:
 Crystal structure of pahasapaite, a beryllophosphate mineral with a
 distorted zeolite rho framework

atoms_sites:
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compound: <missing>
pub_title: Crystal-structure analysis of a birefringent andradite
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formula_title: <missing>
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pub_title:
 Sverigeite, a structure containing planar NaO4 groups and chains of 3- and
 4-membered beryllosilicate rings

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formula: Mn14 B8 (O32 Mg.5) Si.5 Cl.8 H8
compound: <missing>
pub_title: Crystal structure of wiserite
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formula: Zn7 C2 O16 H10
compound: <missing>
formula_title: <missing>
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b: 5.432
c: 15.041
alpha: 90
beta: 95.490
gamma: 90
cell_volume: 1310.193
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pub_title:
 Sclarite, a new mineral from Franklin, New Jersey, with essential octahedrally
 and tetrahedrally coordinated zinc: Description and structure refinement

atoms_sites:
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formula: Al Si3 Na O8
compound: Roc Tourne, France
pub_title: Variation of displacement parameters in structure refinements of low albite
formula_title: <missing>
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beta: 116.60
gamma: 87.71
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compound: Val Pasmeda, Austria
formula_title: <missing>
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cell_volume: 1337.803
crystal_density: 2.763
atoms_occupancy: 0
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pub_title:
 Structural variation associated with compositional variation and order-disorder
 behavior in anorthite-rich feldspars

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pub_title:
 Structural variation associated with compositional variation and order-disorder
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pub_title:
 Structural variation associated with compositional variation and order-disorder
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pub_title:
 Structural variation associated with compositional variation and order-disorder
 behavior in anorthite-rich feldspars
 sample #115082a

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pub_title:
 Crystal structures of natural ternary apatites: Solid solution in the
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formula: Ca5 P3 O12.24 Cl.47 F.29 H.24
compound: <missing>
formula_title: <missing>
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c: 6.8224
alpha: 90
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atoms_aniso_label: "<missing>"
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pub_title:
 Crystal structures of natural ternary apatites: Solid solution in the
 Ca5(PO4)3X (X = F,OH,Cl) system

atoms_sites:
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formula: Fe Mg2 K (Al Si3) O12 H2
compound: <missing>
formula_title: <missing>
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pub_title:
 Crystal-structure refinement of 1M plutonic biotites
 sample M14 from a monzonite in the Valle del Cervo pluton

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formula: Fe Mg2 K (Al Si3) O12 H2
compound: <missing>
formula_title: <missing>
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beta: 100.02
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pub_title:
 Crystal-structure refinement of 1M plutonic biotites
 sample M32 from a syenite in the Valle del Cervo pluton

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formula_title: <missing>
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alpha: 90
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pub_title:
 Crystal-structure refinement of 1M plutonic biotites
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pub_title:
 Crystal-structure refinement of 1M plutonic biotites
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formula_title: <missing>
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pub_title:
 Crystal-structure refinement of 1M plutonic biotites
 sample M62 from a rock transitional between granitic and monzonitic in
 the Valle del Cervo pluton

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compound: <missing>
pub_title: Crystal-structure refinement of a F-bearing spessartine garnet
formula_title: <missing>
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gamma: 90
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formula_title: <missing>
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c: 7.336
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beta: 103.18
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pub_title:
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pub_title:
 Crystal structure determinations of synthetic sodium, magnesium and potassium
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pub_title:
 Crystal structure determinations of synthetic sodium, magnesium and potassium
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pub_title:
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formula: Si O2
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formula: Si O2
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formula: Si O2
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formula: Si O2
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beta: 90
gamma: 90
cell_volume: 327.768
crystal_density: 4.081
atoms_sites: ["CaX", "Zn1", "Ge2", "O1", "O2", "O3"]
atoms_x: gEMUAAAAAACwqwgAgIQeAICLCAAAXwUA
atoms_y: AEEKAAAAAADQ2BUAAAAAAAD5FQDg7AoA
atoms_z: 4L8eAAAAAAAwLDoAIAwLACDoEABgyi8A
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["CaX", "Zn1", "Ge2", "O1", "O2", "O3"]
atoms_aniso_u11: oP0CAEAyAQCA7QAAwLYGAECQAgAANQwA
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atoms_aniso_u13: kAEAAAAAAACAPgAAAAAAAMDg//8guQMA
atoms_aniso_u23: cP7//wAAAACAwf//AAAAAEAfAADAaf7/
pub_title:
 Layer topology, stacking variation and site distortion in melilite-related
 compounds in the system CaO-ZnO-GeO2-SiO2
 high-temperature polymorph
 Ca2ZnGe2O7

qdat:
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formula: Zn Ge2 Ca2.087 O7
compound: <missing>
formula_title: <missing>
a: 8.020
b: 7.995
c: 15.506
alpha: 90
beta: 89.47
gamma: 90
cell_volume: 994.201
crystal_density: 4.071
atoms_u_iso: 0
pub_title:
 Layer topology, stacking variation and site distortion in melilite-related
 compounds in the system CaO-ZnO-GeO2-SiO2
 low-temperature polymorph
 Ca2ZnGe2O7

atoms_sites:
["ZnA1", "ZnA2", "GeA3", "GeA4", "GeA5", "GeA6", "ZnB1", "GeB2", "GeB3", "Caa1", "Caa2", "Cab1", "Cab2", "Cab3", "Cab4a", "Cab4b", "Cab5a", "Cab5b", "OA1", "OA2", "OA3", "OA4", "OA5", "OA6", "OA7", "OA8", "OA9", "OA10", "OA11", "OA12", "OA13", "OA14", "OB1", "OB2", "OB3", "OB4", "OB5", "OB6", "OB7"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_aniso_label:
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atoms_aniso_u11:

atoms_aniso_u22:

atoms_aniso_u33:

atoms_aniso_u12:

atoms_aniso_u13:

atoms_aniso_u23:

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formula: Zn (Ge1.255 Si.745) Ca2 O7
compound: <missing>
formula_title: <missing>
a: 9.112
b: 7.900
c: 9.380
alpha: 90
beta: 114.03
gamma: 90
cell_volume: 616.698
crystal_density: 3.981
atoms_sites: ["Zn1", "Ge2", "Si2", "Ge3", "Si3", "Ca4", "Ca5", "O1", "O2", "O3", "O4", "O5", "O6", "O7"]
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atoms_u_iso: 0
atoms_aniso_label: ["Zn1", "Ge2", "Si2", "Ge3", "Si3", "Ca4", "Ca5", "O1", "O2", "O3", "O4", "O5", "O6", "O7"]
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pub_title:
 Layer topology, stacking variation and site distortion in melilite-related
 compounds in the system CaO-ZnO-GeO2-SiO2
 low-temperature polymorph
 Ca2ZnGe1.25Si.75O7

qdat:
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formula: (Al2 Si3) Cl K3 O10
compound: <missing>
formula_title: K2Al2Si3O10*KCl
a: 9.7553
b: 9.7553
c: 6.4877
alpha: 90
beta: 90
gamma: 90
cell_volume: 617.408
crystal_density: 2.426
atoms_sites: ["Al1", "Si1", "Al2", "Si2", "Cl", "K1", "K2", "O1", "O2", "O3"]
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atoms_u_iso: 0
atoms_aniso_label: ["Al1", "Si1", "Al2", "Si2", "Cl", "K1", "K2", "O1", "O2", "O3"]
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atoms_aniso_u23: AAAAAAAAAAAACgAAAAoAAAAAAAAAAAAA2MP//wAjAAAAFAAAAPv//w==
pub_title:
 Crystal growth and structure of K2Al2Si3O10*KCl: A new anhydrous zeolite-type
 phase with the edingtonite framework

qdat:
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formula: (Ge2.23 Si.77) Ca5 O11
compound: <missing>
formula_title: <missing>
a: 10.912
b: 8.695
c: 11.000
alpha: 90
beta: 96.87
gamma: 90
cell_volume: 1036.185
crystal_density: 3.589
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pub_title:
 Crystal growth and structures of mixed-anion silicates-germanates:
 Ca5[(Ge,Si)2O7][(Ge,Si)O4] and Na2Ca6[Si2O7][SiO4]2
 sample Ca5Ge2.23Si.77O11

atoms_sites:
["Ge1", "Si1", "Ge2", "Si2", "Ge3", "Si3", "Ca1", "Ca2", "Ca3", "Ca4", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8"]

atoms_aniso_label:
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qdat:
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formula: Na2.05 Ca5.95 Si4 O15
compound: <missing>
formula_title: <missing>
a: 5.525
b: 17.413
c: 14.489
alpha: 90
beta: 90.57
gamma: 90
cell_volume: 1393.872
crystal_density: 3.040
pub_title:
 Crystal growth and structures of mixed-anion silicates-germanates:
 Ca5[(Ge,Si)2O7][(Ge,Si)O4] and Na2Ca6[Si2O7][SiO4]2
 sample Na2Ca6Si4O15

atoms_sites:
["Na1", "Ca1", "Na2", "Ca2", "Na3", "Ca1", "Ca2", "Ca3", "Ca4", "Ca5", "Si1", "Si2", "Si3", "Si4", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11a", "O11d", "O12", "O13", "O14", "O15a", "O15b"]

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formula: P Al O5 Li H
compound: <missing>
formula_title: <missing>
a: 6.713
b: 7.708
c: 7.0194
alpha: 91.31
beta: 117.93
gamma: 91.77
cell_volume: 320.464
crystal_density: 3.024
atoms_sites: ["P", "Al1", "Al2", "O1", "O2", "O3", "O4", "O-h", "Li", "H"]
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pub_title:
 The amblygonite-montebrasite series: Characterization by single-crystal
 structure refinement, infrared spectroscopy and multinuclear MAS-NMR
 spectroscopy
 sample AF-47

qdat:
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formula: P Al O4.911 F.089 Li H.911
compound: <missing>
formula_title: <missing>
a: 6.713
b: 7.711
c: 7.0102
alpha: 91.22
beta: 117.91
gamma: 91.67
cell_volume: 320.280
crystal_density: 3.029
atoms_sites: ["P", "Al1", "Al2", "O1", "O2", "O3", "O4", "O-h", "F", "Li1", "Li2", "H"]
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atoms_aniso_u23: 0
pub_title:
 The amblygonite-montebrasite series: Characterization by single-crystal
 structure refinement, infrared spectroscopy and multinuclear MAS-NMR
 spectroscopy
 sample AF-43

qdat:
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compound: <missing>
formula_title: <missing>
a: 6.6984
b: 7.710
c: 6.983
alpha: 91.06
beta: 117.81
gamma: 91.49
cell_volume: 318.682
crystal_density: 3.053
atoms_sites: ["P", "Al1", "Al2", "O1", "O2", "O3", "O4", "O-h", "F", "Li1", "Li2", "H"]
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pub_title:
 The amblygonite-montebrasite series: Characterization by single-crystal
 structure refinement, infrared spectroscopy and multinuclear MAS-NMR
 spectroscopy
 sample A-2

qdat:
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formula: P Al O4.567 (F.433 Li) H.567
compound: <missing>
formula_title: <missing>
a: 6.6837
b: 7.7080
c: 6.9671
alpha: 90.94
beta: 117.75
gamma: 91.36
cell_volume: 317.407
crystal_density: 3.071
atoms_sites: ["P", "Al1", "Al2", "O1", "O2", "O3", "O4", "O-H", "F", "Li1", "Li2"]
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pub_title:
 The amblygonite-montebrasite series: Characterization by single-crystal
 structure refinement, infrared spectroscopy and multinuclear MAS-NMR
 spectroscopy
 sample A-1

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pub_title:
 The amblygonite-montebrasite series: Characterization by single-crystal
 structure refinement, infrared spectroscopy and multinuclear MAS-NMR
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 sample AF-46

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formula: P Al O4 F Li
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formula_title: <missing>
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pub_title:
 The amblygonite-montebrasite series: Characterization by single-crystal
 structure refinement, infrared spectroscopy and multinuclear MAS-NMR
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formula_title: <missing>
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pub_title:
 The amblygonite-montebrasite series: Characterization by single-crystal
 structure refinement, infrared spectroscopy and multinuclear MAS-NMR
 spectroscopy
 sample AF-65

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formula: (Ca.936 Mg.064) C O3
compound: <missing>
pub_title: Single-crystal X-ray structure refinements of two biogenic magnesian calcite crystals sample LS
formula_title: <missing>
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formula: (Ca.871 Mg.129) C O3
compound: <missing>
pub_title: Single-crystal X-ray structure refinements of two biogenic magnesian calcite crystals sample LB
formula_title: <missing>
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formula: Cu2 P2 Mg2 O15 H12
compound: <missing>
pub_title: The crystal structure of nissonite
formula_title: <missing>
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alpha: 90
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formula: Si2.65 Al5.35 O16 Ca2.676
compound: <missing>
pub_title: Crystal structure of synthetic yoshiokaite, a stuffed derivative of the tridymite structure
formula_title: <missing>
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beta: 90
gamma: 120
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formula: Hg6 Si2 O7
compound: <missing>
pub_title: Edgarbaileyite, Hg6Si2O7: The crystal structure of the first mercury silicate
formula_title: <missing>
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b: 7.678
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formula: Mn3 O4
compound: <missing>
pub_title: Rietveld refinement of the high-pressure polymorph of Mn3O4
formula_title: Mn3O4
a: 9.5564
b: 9.7996
c: 3.0240
alpha: 90
beta: 90
gamma: 90
cell_volume: 283.194
crystal_density: 5.367
atoms_sites: ["Mn2+", "Mn3+", "O1", "O2", "O3"]
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formula: Ni Ca Si2 O6
compound: <missing>
formula_title: <missing>
a: 9.7359
b: 8.8932
c: 5.2284
alpha: 90
beta: 105.830
gamma: 90
cell_volume: 435.524
crystal_density: 3.827
atoms_sites: ["Ni1", "Ca2", "Si", "O1", "O2", "O3"]
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atoms_aniso_u23: 0
pub_title:
 Crystal chemistry of synthetic pyroxenes on the join CaNiSi2O6-CaMgSi2O6
 (diopside): A Rietveld refinement study
 sample Ni100, CaNiSi2O6

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formula: (Ni.74 Mg.26) Ca Si2 O6
compound: <missing>
formula_title: <missing>
a: 9.7372
b: 8.8986
c: 5.2313
alpha: 90
beta: 105.826
gamma: 90
cell_volume: 436.097
crystal_density: 3.686
atoms_sites: ["Ni1", "Mg1", "Ca2", "Si", "O1", "O2", "O3"]
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atoms_aniso_u23: 0
pub_title:
 Crystal chemistry of synthetic pyroxenes on the join CaNiSi2O6-CaMgSi2O6
 (diopside): A Rietveld refinement study
 sample Ni80, CaNi.74Mg.26Si2O6

qdat:
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formula: (Ni.45 Mg.55) Ca Si2 O6
compound: <missing>
formula_title: <missing>
a: 9.7390
b: 8.9094
c: 5.2375
alpha: 90
beta: 105.848
gamma: 90
cell_volume: 437.177
crystal_density: 3.525
atoms_sites: ["Ni1", "Mg1", "Ca2", "Si", "O1", "O2", "O3"]
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atoms_aniso_u23: 0
pub_title:
 Crystal chemistry of synthetic pyroxenes on the join CaNiSi2O6-CaMgSi2O6
 (diopside): A Rietveld refinement study
 sample Ni50, CaNi.45Mg.55Si2O6

qdat:
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formula: (Ni.22 Mg.78) Ca Si2 O6
compound: <missing>
formula_title: <missing>
a: 9.7393
b: 8.9095
c: 5.2418
alpha: 90
beta: 105.850
gamma: 90
cell_volume: 437.550
crystal_density: 3.402
atoms_sites: ["Ni1", "Mg1", "Ca2", "Si", "O1", "O2", "O3"]
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atoms_aniso_u33: 0
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atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Crystal chemistry of synthetic pyroxenes on the join CaNiSi2O6-CaMgSi2O6
 (diopside): A Rietveld refinement study
 sample Ni25, CaNi.22Mg.78Si2O6

qdat:
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formula: Mg Ca Si2 O6
compound: <missing>
formula_title: <missing>
a: 9.7470
b: 8.9235
c: 5.2524
alpha: 90
beta: 105.939
gamma: 90
cell_volume: 439.276
crystal_density: 3.274
atoms_sites: ["Mg1", "Ca2", "Si", "O1", "O2", "O3"]
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pub_title:
 Crystal chemistry of synthetic pyroxenes on the join CaNiSi2O6-CaMgSi2O6
 (diopside): A Rietveld refinement study
 sample Ni0, CaMgSi2O6

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pub_title:
 Montesommaite, (K,Na)9Al9Si23O64.10H2O, a new zeolite related to merlinoite and
 the gismondine group

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pub_title:
 Francisite, Cu3Bi(SeO3)2O2Cl, a new mineral from Iron Monarch, South Australia:
 Description and crystal structure

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formula: Si4 Mg12 O21 H2
compound: <missing>
pub_title: Crystal structures of Mg12Si4O19(OH)2 (phase B) and Mg14Si5O24 (phase AnhB)
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 Structures of low gallium albite (NaGaSi3O8) and intermediate germanium albite
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pub_title:
 Structures of low gallium albite (NaGaSi3O8) and intermediate germanium albite
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atoms_sites:
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formula: Fe.37 Al6.25 Mg.84 Si2 B2.54 O18.5
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formula_title: <missing>
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pub_title:
 The crystal structure of werdingite, (Mg,Fe)2Al12(Al,Fe)2Si4(B,Al)4O37, and
 its relationship to sillimanite, mullite and grandidierite

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formula: As Sb
compound: <missing>
pub_title: Crystal chemistry and crystallography of some minerals in the tetradymite group
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pub_title: Crystal chemistry and crystallography of some minerals in the tetradymite group
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pub_title: Crystal chemistry and crystallography of some minerals in the tetradymite group
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formula: K Li Mn2 Si4 O12
compound: <missing>
pub_title: The crystal structure of norrishite, KLiMn2Si4O12: An oxygen-rich mica
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formula: Fe4 O8 Cl.675
compound: corrosion crust on the Camp del Cielo meteorite
pub_title: Crystal structure refinement of akaganeite
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pub_title:
 Grandreefite, Pb2F2SO4: Crystal structure and relationship to the lanthanide
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pub_title:
 Alpha-decay damage in titanite
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pub_title: Alpha-decay damage in titanite sample M28173 annealed at 1090 C, from Gjerstad, Norway
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formula: Ca Ti Si O5
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pub_title: Alpha-decay damage in titanite sample from Cardiff U Mine, Ontario, annealed at 1090 C
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formula: Si1.075 Al1.849 Mg2.076 O9 H4
compound: Mount Sobotka, lower Silesia, Poland
pub_title: The crystal structure of amesite from Mount Sobotka: a nonstandard polytype
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formula_title: <missing>
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
 role of the M2 site population by means of crystal-structure refinement
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
 role of the M2 site population by means of crystal-structure refinement
 sample SBB 37, Di71Jd20, diopside - jadeite join

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formula_title: <missing>
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
 role of the M2 site population by means of crystal-structure refinement
 sample SBB 34, Di62Jd24, diopside - jadeite join

qdat:
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compound: <missing>
formula_title: <missing>
a: 9.654
b: 8.831
c: 5.255
alpha: 90
beta: 106.52
gamma: 90
cell_volume: 429.519
crystal_density: 3.329
atoms_sites: ["Mg1", "Al1", "Fe1", "Ti1", "Ca2", "Na2", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
 role of the M2 site population by means of crystal-structure refinement
 sample SBB 3H, Di64Jd26, diopside - jadeite join

qdat:
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compound: <missing>
formula_title: <missing>
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c: 5.256
alpha: 90
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
 role of the M2 site population by means of crystal-structure refinement
 sample SBB 39, Di52Jd27, diopside - jadeite join

qdat:
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formula: Mg.65 Fe.15 Ti.01 Al.32 Ca.55 Na.3 Si2 O6
compound: <missing>
formula_title: <missing>
a: 9.628
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c: 5.254
alpha: 90
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gamma: 90
cell_volume: 426.360
crystal_density: 3.340
atoms_sites: ["Mg1", "Fe1", "Ti1", "Al1", "Ca2", "Na2", "Fe2", "Mg2", "Si", "O1", "O2", "O3"]
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
 role of the M2 site population by means of crystal-structure refinement
 sample SBB 25, Di55Jd30, diopside - jadeite join

qdat:
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formula: Al.52 Mg.46 Fe.07 Ti.01 Ca.47 Na.41 Si2 O6
compound: <missing>
formula_title: <missing>
a: 9.561
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c: 5.249
alpha: 90
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gamma: 90
cell_volume: 418.977
crystal_density: 3.330
atoms_sites: ["Al1", "Mg1", "Fe1", "Ti1", "Ca2", "Na2", "Fe2", "Mg2", "Si", "O1", "O2", "O3"]
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
 role of the M2 site population by means of crystal-structure refinement
 sample SBB 61, Di47Jd40, diopside - jadeite join

qdat:
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formula: Al.58 Mg.4 Fe.07 Ti.01 Na.47 Ca.45 Si1.97 O6
compound: <missing>
formula_title: <missing>
a: 9.551
b: 8.724
c: 5.247
alpha: 90
beta: 106.97
gamma: 90
cell_volume: 418.159
crystal_density: 3.335
atoms_sites: ["Al1", "Mg1", "Fe1", "Ti1", "Na2", "Ca2", "Fe2", "Si", "Al", "O1", "O2", "O3"]
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
 role of the M2 site population by means of crystal-structure refinement
 sample SBB 37, Di45Jd48, diopside - jadeite join

qdat:
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formula: Al.68 Mg.37 Fe.03 (Na.55 Ca.45) Si1.92 O6
compound: <missing>
formula_title: <missing>
a: 9.545
b: 8.713
c: 5.246
alpha: 90
beta: 106.90
gamma: 90
cell_volume: 417.445
crystal_density: 3.335
atoms_sites: ["Al1", "Mg1", "Fe1", "Na2", "Ca2", "Si", "Al", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAABAmhEAQJoRAIDJBgBA/xUAQIIVAA==
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pub_title:
 Crystal chemistry of clinopyroxenes from mantle eclogites: A study of the key
 role of the M2 site population by means of crystal-structure refinement
 sample SBB 2H, Di46Jd55, diopside - jadeite join

qdat:
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formula: Ca3.895 Na.474 Ce.631 (P2.841 Si.159) O12 F
compound: <missing>
formula_title: <missing>
a: 9.4052
b: 9.4052
c: 6.9125
alpha: 90
beta: 90
gamma: 120
cell_volume: 529.544
crystal_density: 3.505
atoms_sites: ["Ca1", "Na1", "Ce1", "Ca2", "Ce2", "P", "Si", "O1", "O2", "O3", "F"]
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pub_title:
 Rare-earth-element ordering and structural variations in natural
 rare-earth-bearing apatites
 sample from Pajarito, New Mexico

qdat:
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formula: Ca4.641 Na.05 Ce.309 (P2.781 Si.219) O12 F
compound: <missing>
formula_title: <missing>
a: 9.3908
b: 9.3908
c: 6.8988
alpha: 90
beta: 90
gamma: 120
cell_volume: 526.877
crystal_density: 3.364
atoms_sites: ["Ca1", "Na1", "Ce1", "Ca2", "Ce2", "P", "Si", "O1", "O2", "O3", "F"]
atoms_x: q7AoAKuwKACrsCgA+H88APh/PAAAihYAAIoWADCPHQAwfBwAwLIPAAAAAAA=
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pub_title:
 Rare-earth-element ordering and structural variations in natural
 rare-earth-bearing apatites
 sample from Kipawa, Quebec

qdat:
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formula: Ca4.825 Na.01 Ce.165 (P2.841 Si.159) O12.26 F.74 H.26
compound: <missing>
formula_title: <missing>
a: 9.3995
b: 9.3995
c: 6.8941
alpha: 90
beta: 90
gamma: 120
cell_volume: 527.494
crystal_density: 3.272
atoms_sites: ["Ca1", "Na1", "Ce1", "Ca2", "Ce2", "P", "Si", "O1", "O2", "O3", "F", "O-H"]
atoms_x: q7AoAKuwKACrsCgA4I08AOCNPAC4gRYAuIEWAJCYHQCwbxwAULQPAAAAAAAAAAAA
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pub_title:
 Rare-earth-element ordering and structural variations in natural
 rare-earth-bearing apatites
 sample from the Oka carbonatite

qdat:
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formula: Ca4.557 Na.02 Ce.423 (P2.595 Si.405) O12.664 F.335 H.664
compound: <missing>
formula_title: <missing>
a: 9.4202
b: 9.4202
c: 6.9157
alpha: 90
beta: 90
gamma: 120
cell_volume: 531.480
crystal_density: 3.398
atoms_sites: ["Ca1", "Na1", "Ce1", "Ca2", "Ce2", "P", "Si", "O1", "O2", "O3", "F", "O-H"]
atoms_x: q7AoAKuwKACrsCgAgHo8AIB6PAAAhRYAAIUWAKCNHQCwbxwA8KoPAAAAAAAAAAAA
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pub_title:
 Rare-earth-element ordering and structural variations in natural
 rare-earth-bearing apatites
 sample B from the Oka carbonatite

qdat:
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formula: Si2.856 Al1.369 (K.955 Ca.03 Na.015) Mg2.166 Cr.048 Fe.39 Mn.021 Ti.144 O12
compound: <missing>
formula_title: <missing>
a: 5.317
b: 9.207
c: 10.232
alpha: 90
beta: 99.98
gamma: 90
cell_volume: 493.314
crystal_density: 2.915
atoms_u_iso: 0
pub_title:
 Effect of Ti substitution in biotite-M crystal chemistry
 Sample 8 from a lamproite rock, Puebla De Mula, Spain

atoms_sites:
["Si", "Al", "K", "Ca", "Na", "Mg1", "Al1", "Cr1", "Fe1", "Mn1", "Ti1", "Mg2", "Al2", "Cr2", "Fe2", "Mn2", "Ti2", "O1", "O2", "O3", "O4"]

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atoms_occupancy:
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atoms_aniso_label:
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qdat:
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formula: (Si2.908 Al1.092) K.952 Ca.006 Na.024 Mg2.424 Cr.024 Fe.282 Mn.015 Ti.177 O12
compound: <missing>
formula_title: <missing>
a: 5.306
b: 9.190
c: 10.163
alpha: 90
beta: 100.11
gamma: 90
cell_volume: 487.875
crystal_density: 2.902
atoms_u_iso: 0
pub_title:
 Effect of Ti substitution in biotite-M crystal chemistry
 Sample 9 from a lamproite rock, Cancarix, Spain

atoms_sites:
["Si", "Al", "K", "Ca", "Na", "Mg1", "Cr1", "Fe1", "Mn1", "Ti1", "Mg2", "Cr2", "Fe2", "Mn2", "Ti2", "O1", "O2", "O3", "O4"]

atoms_x:
kJgEAJCYBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAwFcBAGCqEwBQ/QcA0AkIAA==

atoms_y:
QC4KAEAuCgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAABB3FAAQdxQAEHcUABB3FAAQdxQAAAAAAOA+DgCANAoAgIQeAA==

atoms_z:
IMgNACDIDQAAAAAAAAAAAAAAAACAhB4AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AIEQKAIA0CgDw3hcAYHMYAA==

atoms_occupancy:
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atoms_aniso_label:
["Si", "Al", "K", "Ca", "Na", "Mg1", "Cr1", "Fe1", "Mn1", "Ti1", "Mg2", "Cr2", "Fe2", "Mn2", "Ti2", "O1", "O2", "O3", "O4"]

atoms_aniso_u11:
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atoms_aniso_u22:
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atoms_aniso_u33:
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atoms_aniso_u12:
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atoms_aniso_u13:
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atoms_aniso_u23:
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qdat:
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formula: Si2.932 Al1.161 K.958 Ca.004 Na.016 Mg1.602 Cr.054 Fe.588 Mn.03 Ti.522 O12
compound: <missing>
formula_title: <missing>
a: 5.322
b: 9.228
c: 10.102
alpha: 90
beta: 100.25
gamma: 90
cell_volume: 488.206
crystal_density: 3.026
atoms_u_iso: 0
pub_title:
 Effect of Ti substitution in biotite-M crystal chemistry
 Sample 10 from a lamproite rock, Fortuna, Spain

atoms_sites:
["Si", "Al", "K", "Ca", "Na", "Mg1", "Al1", "Cr1", "Fe1", "Mn1", "Ti1", "Mg2", "Al2", "Cr2", "Fe2", "Mn2", "Ti2", "O1", "O2", "O3", "O4"]

atoms_x:
8IgEAPCIBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACwxgEAsHMTABAQCADA+wcA

atoms_y:
YDEKAGAxCgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQdxQAEHcUABB3FAAQdxQAEHcUABB3FAAAAAAAAHQOAPBLCgCAhB4A

atoms_z:
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atoms_occupancy:
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atoms_aniso_u11:
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atoms_aniso_u22:
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atoms_aniso_u33:
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atoms_aniso_u12:
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atoms_aniso_u13:
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atoms_aniso_u23:
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qdat:
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formula: Si2.868 Al1.282 K.955 Ca.013 Na.03 Mg1.899 Cr.072 Fe.504 Mn.027 Ti.324 O12
compound: <missing>
formula_title: <missing>
a: 5.315
b: 9.204
c: 10.168
alpha: 90
beta: 100.13
gamma: 90
cell_volume: 489.657
crystal_density: 2.989
atoms_u_iso: 0
pub_title:
 Effect of Ti substitution in biotite-M crystal chemistry
 Sample 11 from a lamproite rock, Jummilla, Spain

atoms_x:
UJIEAFCSBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABASwEA4LYTAOD+BwAAAggA

atoms_y:
0C8KANAvCgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAiBQAQIgUAECIFABAiBQAQIgUAECIFAAAAAAA8DMOAMA6CgCAhB4A

atoms_z:
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atoms_occupancy:
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atoms_aniso_u11:
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atoms_aniso_u22:
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atoms_aniso_u33:
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atoms_aniso_u12:
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atoms_aniso_u13:
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atoms_aniso_u23:
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qdat:
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formula: Si2.904 Al1.135 (K.947 Ca.002 Na.051) Mg2.088 Cr.054 Fe.498 Mn.018 Ti.267 O12
compound: <missing>
formula_title: <missing>
a: 5.314
b: 9.190
c: 10.160
alpha: 90
beta: 100.18
gamma: 90
cell_volume: 488.359
crystal_density: 2.976
atoms_u_iso: 0
pub_title:
 Effect of Ti substitution in biotite-M crystal chemistry
 Sample 12 from a lamproite rock, Jummilla, Spain

atoms_x:
4JMEAOCTBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABgTgEAEK8TADD6BwBwAAgA

atoms_y:
QC4KAEAuCgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABQfRQAUH0UAFB9FABQfRQAUH0UAFB9FAAAAAAAoDgOAKA3CgCAhB4A

atoms_z:
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atoms_occupancy:
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atoms_aniso_u11:
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atoms_aniso_u22:
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atoms_aniso_u33:
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atoms_aniso_u12:
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atoms_aniso_u13:
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atoms_aniso_u23:
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qdat:
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formula: Si2.736 Al1.27 K.915 Ca.007 Na.015 Mg1.476 Cr.006 Fe.942 Mn.024 Ti.39 O12
compound: <missing>
formula_title: <missing>
a: 5.329
b: 9.235
c: 10.190
alpha: 90
beta: 100.20
gamma: 90
cell_volume: 493.558
crystal_density: 3.016
atoms_u_iso: 0
pub_title:
 Effect of Ti substitution in biotite-M crystal chemistry
 Sample 15 from a alkaline gabbro-peralkaline syenite rock, Mt St Hilaire, Quebec

atoms_x:
YIcEAGCHBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADgDwEAMMsTADD6BwBQ5AcA

atoms_y:
8DIKAPAyCgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAjhQAgI4UAICOFACAjhQAgI4UAICOFAAAAAAA8BoOALBFCgCAhB4A

atoms_z:
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atoms_occupancy:
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atoms_aniso_u11:
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atoms_aniso_u22:
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atoms_aniso_u33:
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atoms_aniso_u12:
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atoms_aniso_u13:
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atoms_aniso_u23:
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qdat:
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formula: Si2.832 Al1.249 K.968 Ca.009 Na.02 Mg1.401 Cr.006 Fe1.239 Mn.024 Ti.231 O12
compound: <missing>
formula_title: <missing>
a: 5.333
b: 9.256
c: 10.186
alpha: 90
beta: 100.17
gamma: 90
cell_volume: 494.904
crystal_density: 3.086
atoms_u_iso: 0
pub_title:
 Effect of Ti substitution in biotite-M crystal chemistry
 Sample 16 from a monzonite-alkali syenite, Sande caldron, Norway

atoms_x:
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atoms_y:
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atoms_z:
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atoms_occupancy:
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atoms_aniso_u11:
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atoms_aniso_u22:
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atoms_aniso_u33:
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atoms_aniso_u12:
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atoms_aniso_u13:
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atoms_aniso_u23:
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qdat:
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formula: Si2.764 Al1.428 K.914 Ca.001 Na.022 Mg1.245 Cr.006 Fe1.296 Mn.009 Ti.198 O12
compound: <missing>
formula_title: <missing>
a: 5.323
b: 9.215
c: 10.210
alpha: 90
beta: 100.14
gamma: 90
cell_volume: 492.993
crystal_density: 3.081
atoms_u_iso: 0
pub_title:
 Effect of Ti substitution in biotite-M crystal chemistry
 Sample 17 from a quartz diorite, Capo Vaticano, Italy

atoms_x:
8KEEAPChBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACQ4gAAkNQTAGDyBwBQ5AcA

atoms_y:
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atoms_z:
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atoms_occupancy:
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atoms_aniso_u11:
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atoms_aniso_u13:
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atoms_aniso_u23:
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qdat:
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formula: B Fe.85 Cr.02 Ti.04 Al.02 Mg1.07 O4
compound: Jumilla, Murcia province, southeast Spain
pub_title: Crystal chemistry of Fe- and Cr-rich warwickite sample S1
formula_title: <missing>
a: 9.246
b: 3.0927
c: 9.384
alpha: 90
beta: 90
gamma: 90
cell_volume: 268.336
crystal_density: 3.757
atoms_sites: ["B", "Fe1", "Cr1", "Ti1", "Al1", "Mg1", "Mg2", "O1", "O2", "O3", "O4"]
atoms_x: 4D0KAOAOBwDgDgcA4A4HAOAOBwDgDgcA8EUGAEBLAQDQEQ8AsJEOADCOAAA=
atoms_y: QEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwA=
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atoms_occupancy: AAk9AEDhMwCAOAEAAHECAIA4AQDARQQAAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["B", "Fe1", "Cr1", "Ti1", "Al1", "Mg1", "Mg2", "O1", "O2", "O3", "O4"]
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atoms_aniso_u33: MMoAABDRAAAQ0QAAENEAABDRAAAQ0QAA+AEBACDfAADw+gAASLwAAEC1AAA=
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atoms_aniso_u13: wA0AAEDy//9A8v//QPL//0Dy//9A8v//4AYAAGDr///ADQAA4AYAAOAGAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
qdat:
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formula: B Al.01 Cr.23 Fe.5 Ti.12 Mg1.14 O4
compound: Jumilla, Murcia province, southeast Spain
pub_title: Crystal chemistry of Fe- and Cr-rich warwickite sample S2
formula_title: <missing>
a: 9.226
b: 3.0860
c: 9.369
alpha: 90
beta: 90
gamma: 90
cell_volume: 266.749
crystal_density: 3.696
atoms_sites: ["B", "Al1", "Cr1", "Fe1", "Ti1", "Mg1", "Mg2", "O1", "O2", "O3", "O4"]
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atoms_y: QEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwA=
atoms_z: AGs1ABC5IgAQuSIAELkiABC5IgAQuSIA4JsLAID6NABQli0AEFkAAJBxFwA=
atoms_occupancy: AAk9AECcAADACQ4AgIQeAABTBwCAiwgAAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["B", "Al1", "Cr1", "Fe1", "Ti1", "Mg1", "Mg2", "O1", "O2", "O3", "O4"]
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atoms_aniso_u22: kDwBAMjNAADIzQAAyM0AAMjNAADIzQAACMoAAAgpAQAIAQEAkGQBAIj5AAA=
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pub_title: Crystal chemistry of Fe- and Cr-rich warwickite sample S5
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pub_title: Crystal chemistry of Fe- and Cr-rich warwickite sample S6
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pub_title: Crystal chemistry of Fe- and Cr-rich warwickite sample S7
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formula: Pb2 Mn1.68 Fe.32 Si2 O9
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pub_title:
 The kentrolite-melanotekite series, 4Pb2(Mn,Fe)2O2[Si2O7]: Chemical
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formula: Mg3 P2 B2 O20 H18
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pub_title: The crystal structure of luneburgite, Mg3(H2O)6[B2(OH)6(PO4)2]
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pub_title:
 The remarkable langbanite structure type: Crystal structure, chemical
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formula: (Mg Al2) O4
compound: <missing>
formula_title: <missing>
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b: 8.08435
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alpha: 90
beta: 90
gamma: 90
cell_volume: 528.367
crystal_density: 3.577
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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample UC, T = 293 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample W, T = 873 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample UC, T = 923 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample W, T = 973 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample UC, T = 973 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample UC, T = 1023 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample W, T = 1073 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample UC, T = 1073 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample UC, T = 1123 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample W, T = 1173 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample UC, T = 1173 K

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formula: (Mg Al2) O4
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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample W, T = 1273 K

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pub_title:
 A time-of-flight neutron powder diffraction study of MgAl2O4 at temperatures
 up to 1273 K
 sample UC, T = 1273 K

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formula: Si4 Cu4 Pb4 C4 O28 Cl
compound: <missing>
formula_title: <missing>
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b: 14.234
c: 6.103
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beta: 90
gamma: 90
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atoms_aniso_u23: AAAAACDq//8AAAAAAAAAAIA+AAAAAAAAAAAAAAAAAABgZwEAAAAAAA==
pub_title:
 Ashburtonite, a new bicarbonate-silicate mineral from Ashburton Downs, Western
 Australia: Description and structure determination

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formula: Mn Mg2 Zn2 O14
compound: <missing>
pub_title: The crystal structure of cianciulliite, Mn(Mg,Mn)2Zn2(OH)10*2-4H2O
formula_title: <missing>
a: 15.405
b: 6.344
c: 5.562
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atoms_sites: ["Mn", "Mg", "Zn", "O1", "O2", "O3", "O4", "O5"]
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formula: Fe.332 Mg3.158 Al7.08 Si3.56 H.6 O21.75 F.25
compound: <missing>
formula_title: <missing>
a: 16.117
b: 13.728
c: 6.749
alpha: 90
beta: 90
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cell_volume: 1493.245
crystal_density: 3.290
pub_title:
 The crystal structure of B-free kornerupine: Conditions favoring the
 incorporation of variable amounts of B through B = Si substitution in
 kornerupine
 Note: Sample is from the Sinyoni Claims in the Limpopo Belt near Beit Bridge, Zimbabwe

atoms_sites:
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pub_title:
 The crystal chemistry of the milarite-group minerals
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 Note: U(1,2) of WatB/NaB changed to match symmetry constraints

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pub_title:
 The crystal chemistry of the milarite-group minerals
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 Note: U(1,2) of WatB/NaB/KC changed to match symmetry constraints

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pub_title:
 The crystal chemistry of the milarite-group minerals
 sample #35 from east Siberia
 Note: U(1,2) of WatB/NaB changed to match symmetry constraints

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pub_title: The crystal chemistry of the milarite-group minerals sample #30 from Rossing
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formula: Ca1.532 Y.468 Na.048 K Si12 (Al.48 Be2.52) O30
compound: <missing>
pub_title: The crystal chemistry of the milarite-group minerals sample #36 from Jaguaracu
formula_title: <missing>
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formula: Ca1.38 Y.62 Na.02 K Si12 (Al.36 Be2.64) O30
compound: <missing>
pub_title: The crystal chemistry of the milarite-group minerals sample #37 from Strange Lake
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compound: <missing>
formula_title: <missing>
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alpha: 90
beta: 90
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pub_title:
 Ordering of divalent cations in the apatite structure: Crystal structure
 refinements of natural Mn- and Sr-bearing apatite
 sample Sr.63

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pub_title:
 Ordering of divalent cations in the apatite structure: Crystal structure
 refinements of natural Mn- and Sr-bearing apatite
 sample Sr.29

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compound: <missing>
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alpha: 90
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atoms_sites: ["Ca1", "Mn1", "Ca2", "Mn2", "P", "O1", "O2", "O3", "F"]
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pub_title:
 Ordering of divalent cations in the apatite structure: Crystal structure
 refinements of natural Mn- and Sr-bearing apatite
 sample Mn1.21

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compound: <missing>
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pub_title:
 Ordering of divalent cations in the apatite structure: Crystal structure
 refinements of natural Mn- and Sr-bearing apatite
 sample Mn.42

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formula: Na4 Ca1.82 K.4 Mg.04 (Al4.08 Si13.92) O48.76 H12.76
compound: <missing>
formula_title: <missing>
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pub_title:
 Stepwise dehydration of heulandite-clinoptilolite from Succor Creek, Oregon,
 U.S.A.: A single-crystal X-ray study at 100 K
 sample name: natural

atoms_sites:
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pub_title:
 Stepwise dehydration of heulandite-clinoptilolite from Succor Creek, Oregon,
 U.S.A.: A single-crystal X-ray study at 100K
 sample name: dehyd1

atoms_sites:
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pub_title:
 Stepwise dehydration of heulandite-clinoptilolite from Succor Creek, Oregon,
 U.S.A.: A single-crystal X-ray study at 100K
 sample name: dehyd2

atoms_sites:
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pub_title:
 Stepwise dehydration of heulandite-clinoptilolite from Succor Creek, Oregon,
 U.S.A.: A single-crystal X-ray study at 100K
 sample name: dehyd3

atoms_sites:
["Na1*", "Na1*", "Ca2", "K3", "Al1", "Si1", "Al2", "Si2", "Al3", "Si3", "Al4", "Si4", "Al5", "Si5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O-H11", "O-H12", "O-H13", "O-H13'", "O-H14", "O-H15", "O-H16", "O-H16'", "O-H18"]

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compound: <missing>
formula_title: <missing>
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pub_title:
 Stepwise dehydration of heulandite-clinoptilolite from Succor Creek, Oregon,
 U.S.A.: A single-crystal X-ray study at 100K
 sample name: dehyd4

atoms_sites:
["Na1*", "Ca2*", "K3*", "Al1", "Si1", "Al2", "Si2", "Al3", "Si3", "Al4", "Si4", "Al5", "Si5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O-H19", "O-H20"]

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formula: Cs Mg Cl3 O6 H12
compound: <missing>
formula_title: [Mg(H2O)6]CsCl3
a: 6.7507
b: 13.495
c: 6.750
alpha: 90.13
beta: 91.15
gamma: 90.18
cell_volume: 614.801
crystal_density: 2.008
atoms_occupancy: 0
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pub_title:
 Crystallographic investigations of [Mg(H2O)6]XCl3 double salts
 (X = K, Rb, Cs, NH4): Crystal structure of [Mg(H2O)6]CsCl3
 Note: modified perovskite structure

atoms_sites:
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compound: <missing>
formula_title: <missing>
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b: 5.727
c: 5.120
alpha: 90
beta: 90
gamma: 90
cell_volume: 416.053
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pub_title:
 Cation distribution in partially ordered columbite from the Kings Mountain
 pegmatite, North Carolina
 sample NCP5, T = 100 K

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formula_title: <missing>
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beta: 90
gamma: 90
cell_volume: 415.526
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pub_title:
 Cation distribution in partially ordered columbite from the Kings Mountain
 pegmatite, North Carolina
 SAMPLE ncp1, T = 293 K

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formula: P2 (Mn1.5 Fe1.5) O8
compound: <missing>
pub_title: Occurrence and crystal structure of Ca-free beusite in the El Sampal IIIA iron meteorite
formula_title: <missing>
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c: 6.136
alpha: 90
beta: 99.09
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crystal_density: 3.917
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qdat:
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formula: Si9 Al9 O44.997 Na10.998 K4.002 S1.5 H5.994
compound: <missing>
formula_title: <missing>
a: 22.121
b: 22.121
c: 5.221
alpha: 90
beta: 90
gamma: 120
cell_volume: 2212.554
crystal_density: 2.520
atoms_aniso_label: "<missing>"
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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:
 Pitiglianoite, a new feldspathoid from southern Tuscany, Italy: Chemical
 composition and crystal structure

atoms_sites:
["Si1", "Si2", "Si3", "Al1", "Al2", "Al3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "Na", "Wat1", "Wat2", "Wat3", "K1", "Na1", "Na1", "S1", "OA1", "OB1", "K2", "Na2", "Na2", "S2", "OA2", "OB2"]

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formula: Na B Si3 O8
compound: <missing>
formula_title: <missing>
a: 7.8388
b: 12.3730
c: 6.8082
alpha: 93.324
beta: 116.381
gamma: 92.014
cell_volume: 589.191
crystal_density: 2.774
atoms_sites: ["Na", "B1o", "Si1m", "Si2o", "Si2m", "Oa1", "Oa2", "Obo", "Obm", "Oco", "Ocm", "Odo", "Odm"]
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atoms_occupancy: 0
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atoms_aniso_label: ["Na", "B1o", "Si1m", "Si2o", "Si2m", "Oa1", "Oa2", "Obo", "Obm", "Oco", "Ocm", "Odo", "Odm"]
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atoms_aniso_u23: OIf//9gJAADIDwAA2AkAAMgPAADAFwAAqBsAAEDo///YEwAAMPj//9ARAADYEwAAKPb//w==
pub_title:
 Tetrahedral-site occupancies in reedmergnerite and synthetic boron albite
 (NaBSi3O8)
 sample from Utah

qdat:
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formula: Na B Si2.9 O8
compound: <missing>
formula_title: <missing>
a: 7.852
b: 12.350
c: 6.806
alpha: 93.37
beta: 116.30
gamma: 91.58
cell_volume: 589.590
crystal_density: 2.740
atoms_x: AB0QALCBAACwgQAAMHUAADB1AABQ2ioAUNoqAODhKQDg4SkAUF8AABBiJACAODMAkOgxACCZAACg0QEAUJoLAFCzCwA=
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pub_title:
 Tetrahedral-site occupancies in reedmergnerite and synthetic boron albite
 (NaBSi3O8)
 sample low boron albite Gb100

atoms_sites:
["Na", "B1o", "Sio", "Si1m", "B1m", "Si2o", "B2o", "Si2m", "B2m", "Oa1", "Oa2", "Obo", "Obm", "Oco", "Ocm", "Odo", "Odm"]

atoms_aniso_label:
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qdat:
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formula: Na (B Si3) O8
compound: <missing>
formula_title: <missing>
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b: 12.336
c: 6.820
alpha: 93.54
beta: 116.13
gamma: 90.60
cell_volume: 595.799
crystal_density: 2.743
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pub_title:
 Tetrahedral-site occupancies in reedmergnerite and synthetic boron albite
 (NaBSi3O8)
 sample high boron albite Gb87, known as reedmergnerite-high

atoms_sites:
["Na", "B1o", "Si1o", "B1m", "Si1m", "B2o", "Si2o", "B2m", "Si2m", "Oa1", "Oa2", "Obo", "Obm", "Oco", "Ocm", "Odo", "Odm"]

atoms_aniso_label:
["Na", "B1o", "Si1o", "B1m", "Si1m", "B2o", "Si2o", "B2m", "Si2m", "Oa1", "Oa2", "Obo", "Obm", "Oco", "Ocm", "Odo", "Odm"]

qdat:
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formula: (Al1.5 Si2.5) O11.02 Ca.704 Na.2 H6.04
compound: Goble, Oregon
pub_title: The crystal structure of garronite
formula_title: <missing>
a: 9.9266
b: 9.9266
c: 10.3031
alpha: 90
beta: 90
gamma: 90
cell_volume: 1015.241
crystal_density: 2.132
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atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
atoms_sites:
["Al1", "Si1", "Al2", "Si2", "O11", "O12", "O2", "Ca1", "Ca2", "Na", "Wat1", "Wat2", "Wat2b", "Wat3"]

qdat:
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formula: (Al.75 Si1.25) O5.57 Ca.436 H3.14
compound: Fara Vicentina, Italy
pub_title: The crystal structure of garronite
formula_title: <missing>
a: 9.8712
b: 9.8712
c: 10.2987
alpha: 90
beta: 90
gamma: 90
cell_volume: 1003.511
crystal_density: 2.186
atoms_sites: ["Al1", "Si1", "Al2", "Si2", "O11", "O12", "O2", "Ca1", "Ca2", "Wat1", "Wat1b", "Wat2"]
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atoms_aniso_label: "<missing>"
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atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
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qdat:
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formula: Hg Ag S (Cl.82 Br.18)
compound: <missing>
pub_title: Capgaronnite, HgSAg(Cl,Br,I), a new sulfide-halide mineral from Var, France
formula_title: <missing>
a: 6.803
b: 12.87
c: 4.528
alpha: 90
beta: 90
gamma: 90
cell_volume: 396.447
crystal_density: 6.433
atoms_sites: ["Hg", "Ag", "S", "Cl", "Br"]
atoms_x: wC0IAODCEQDAzRcAYGAXAGBgFwA=
atoms_y: IHEPAICvAgBA9QYA4KoVAOCqFQA=
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qdat:
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formula: Si5 Mg12.364 Fe1.616 O24
compound: <missing>
pub_title: Crystal chemistry of Fe-bearing anhydrous phase B: Implications for transition zone mineralogy
formula_title: <missing>
a: 5.908
b: 14.241
c: 10.069
alpha: 90
beta: 90
gamma: 90
cell_volume: 847.164
crystal_density: 3.588
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
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atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
atoms_sites:
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atoms_z:
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atoms_occupancy:
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qdat:
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formula: Al2 Si O5
compound: <missing>
formula_title: <missing>
a: 7.4841
b: 7.6720
c: 5.7707
alpha: 90
beta: 90
gamma: 90
cell_volume: 331.342
crystal_density: 3.248
atoms_sites: ["Al1", "Al2", "Si2", "Si3", "Al3", "OA", "OB", "OC", "OD"]
atoms_x: AAAAAEC3CABAtwgAQE0JAEBNCQDwAxYAILEVAHAxHQCAqgcA
atoms_y: AAAAABD0FAAQ9BQAQNMUAEDTFADQ1RgAEJ4aALA2AADgjw0A
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atoms_u_iso: 0CAAAHAwAABwMAAAwCsAAMArAACQGgAA8CMAAPCHAACQMwAA
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:
 Rietveld refinement of the crystal structure of fibrolitic sillimanite using
 neutron powder diffraction data

qdat:
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formula: Fe1.89 Ca.75 Mg.24 Mn.09 Al2 Si3 O12
compound: <missing>
pub_title: Crystal chemistry and symmetry of a birefringent tetragonal pyralspite75-grandite25 garnet
formula_title: <missing>
a: 11.6207
b: 11.6207
c: 11.6230
alpha: 90
beta: 90
gamma: 90
cell_volume: 1569.578
crystal_density: 4.034
atoms_sites: ["Fe1", "Ca1", "Mg1", "Mn1", "Fe2", "Ca2", "Mg2", "Mn2", "AlY", "Si1", "Si3", "O1", "O2", "O3"]
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 Single-crystal X-ray structure study of synthetic pyrope almandine garnets at
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 Single-crystal X-ray structure study of synthetic pyrope almandine garnets at
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 Single-crystal X-ray structure study of synthetic pyrope almandine garnets at
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 Single-crystal X-ray structure study of synthetic pyrope almandine garnets at
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pub_title:
 Single-crystal X-ray structure study of synthetic pyrope almandine garnets at
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pub_title:
 Single-crystal X-ray structure study of synthetic pyrope almandine garnets at
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pub_title:
 Single-crystal X-ray structure study of synthetic pyrope almandine garnets at
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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pub_title:
 Structural variation in nickel aluminate spinel (NiAl2O4)
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 The temperature dependence of the cation distribution in magnesioferrite
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 The temperature dependence of the cation distribution in magnesioferrite
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 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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pub_title:
 The temperature dependence of the cation distribution in magnesioferrite
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 Eglestonite, [Hg2]3Cl3O2H: Confirmation of the chemical formula by neutron
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