# cif

formula: Ca3 Be2 P4 O20 H10
compound: <missing>
formula_title: <missing>
a: 7.3275
b: 7.6959
c: 7.0606
alpha: 94.903
beta: 96.820
gamma: 101.865
cell_volume: 384.414
crystal_density: 2.558
atoms_occupancy: 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
pub_title:
 Beryllophosphate chains in the structures of fransoletite, parafransoletite, and
 ehrleite and some general comments on beryllophosphate linkages

atoms_sites:
["Ca1", "Ca2", "Be", "P1", "P2", "O1", "O-h2", "O3", "O4", "O5", "O6", "O7", "O8", "OW1", "OW2", "H", "H1a", "H1b", "H2a", "H2b"]

atoms_x:
cForAAAAAABgwywA4J8CADC/FQAQTzwA8CUIAODmCwAwlTUAEEAZAADSDwBwLQ0AQA4gAJCyIQCwZy4AIB4IAABGHgAACigAoN0xAODBJgA=

atoms_y:
MOUXAAAAAADQnRkAwG4SAMBuEgAwpREAgHIIAFDjHACAhxEAMC8UAADuGwAgiAcAQHsSAGDABwCAqgcAoN8HAGC6CABA+wUAYCsLAOAWBAA=

atoms_z:
wKQ7AAAAAADgrB0AMMQpALBTEAAQ9jUAkMYmAFBEKgBgQyAAwF4EACBZEwCwOhAAoKUZAADmLQCQ/QgAwJ0fAACTJgCghCsAIHEPAEBmCQA=

atoms_u_iso:
+MUAAGjxAACYigAAcJQAAHiWAACA7QAAMAEBAPjFAABIngAAgO0AACCyAACA7QAAqNkAAAgVAQCA7QAASHkCAEh5AgBIeQIASHkCAEh5AgA=

qdat:
AAAAAAAAAAAAAAigAAAAACEAAAAAgkgAAQMoAAAEMAgIRwQEC8gBAGICpYgmXGBVCgENDRkNETORAckUCjIcsQDt+HUvdOlB2q3TBPwuJf9aKpbf/SGFpj7aV3L13t8nu3+lXjf7n/+/3//Tt/3uX77375uvx8+xd9/+k5==


formula: Cu Fe2 S3
compound: <missing>
pub_title: High-pressure crystal chemistry of cubanite, CuFe2S3 P = 0 GPa, in air
formula_title: <missing>
a: 6.46
b: 11.10
c: 6.22
alpha: 90
beta: 90
gamma: 90
cell_volume: 446.011
crystal_density: 4.042
atoms_sites: ["Cu", "Fe", "S1", "S2"]
atoms_x: wJ4jABhRGQCQvyMAQB8ZAA==
atoms_y: QEIPAAg0GQBAQg8AaFsZAA==
atoms_z: MH0HAIDbJgAQPy4AWEwQAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Cu", "Fe", "S1", "S2"]
atoms_aniso_u11: ODoBAKi2AACYwQAAwMsAAA==
atoms_aniso_u22: CD0BALCpAACIrgAAIMEAAA==
atoms_aniso_u33: 6P0AAAjAAAD4ygAAOL0AAA==
atoms_aniso_u12: AAAAAJD8//8AAAAAkPz//w==
atoms_aniso_u13: AAAAALgLAAAAAAAAQPL//w==
atoms_aniso_u23: AAAAAHgFAAAAAAAAMOT//w==
qdat:
AAAAAAAAAAAAAAAAAABIAAAIAQAAAAgAEjAAGOGAARAgIATCACWMOxDAKRCSyQghBVIvQbxhCmDvNyJiwhX7fSrn5Nf4dGtfs7H/d9Osur3nw/w73TWXpufr/Wb7934/j3/z/t//m9v3fPm+ef991/777V/713K9639/v/==


formula: Cu Fe2 S3
compound: <missing>
pub_title: High-pressure crystal chemistry of cubanite, CuFe2S3 P = 0 GPa, in the cell
formula_title: <missing>
a: 6.455
b: 11.102
c: 6.226
alpha: 90
beta: 90
gamma: 90
cell_volume: 446.176
crystal_density: 4.041
atoms_sites: ["Cu", "Fe", "S1", "S2"]
atoms_x: sJAjAMArGQCAYCQAQIMZAA==
atoms_y: QEIPAMArGQBAQg8A4GAZAA==
atoms_z: EGEHABDsJgAwWy4AkDcQAA==
atoms_occupancy: 0
atoms_u_iso: 8HcBAGD5AAC4MgEA8BgBAA==
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:
AAAAAAAAAAAAAAAAAABIAAAIAQAAAAgAEjAAGPEAARAgIATCABsMOxDASJBTyQRBB3IvQzxiDeCvM0JjQh3reyVnqZX4dGtPs7F//dak2r3nw3wr2bVX5uff9Wd9b/pvj39y/tf9z5b+fP1+ef3t2/d+27/rn+e/Zvd//3==


formula: Cu Fe2 S3
compound: <missing>
pub_title: High-pressure crystal chemistry of cubanite, CuFe2S3 P = 1.7 GPa
formula_title: <missing>
a: 6.404
b: 11.010
c: 6.158
alpha: 90
beta: 90
gamma: 90
cell_volume: 434.189
crystal_density: 4.152
atoms_sites: ["Cu", "Fe", "S1", "S2"]
atoms_x: oJsjAGAiGQCAYCQAwCsZAA==
atoms_y: QEIPAHAwGQBAQg8A8FUZAA==
atoms_z: ACEHAHCqJgBAHi4AUP8PAA==
atoms_occupancy: 0
atoms_u_iso: qJcBAOAoAQD4GgEAcEgBAA==
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:
AAAAAAAAAAAAAAAAAAAkAAACAEAAAAIACQgABjggAEIIBACYQAVhh0EYBiESWJCEIL0k2C/OEK4G81oiLEHts+jbP2t7Q8LWfa3O+96PJ69epwfg93ROm4+fffLd8+34fx7/Y929+5dV9/37KnjNfOf96r8v9e7xuvbf29==


formula: Cu Fe2 S3
compound: <missing>
pub_title: High-pressure crystal chemistry of cubanite, CuFe2S3 P = 3.6 GPa
formula_title: <missing>
a: 6.344
b: 10.919
c: 6.098
alpha: 90
beta: 90
gamma: 90
cell_volume: 422.409
crystal_density: 4.268
atoms_sites: ["Cu", "Fe", "S1", "S2"]
atoms_x: 8JYjACDRGADgSiUA0OgZAA==
atoms_y: QEIPAEA4GQBAQg8AIE4ZAA==
atoms_z: oMwGAKBwJgBwyy0AQKYPAA==
atoms_occupancy: 0
atoms_u_iso: eEoBAEAFAQB4SgEAeOsAAA==
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:
AAAAAAAAAAAAAAAAAAASAAABACAAAAEAAkIAAYcIABCBAQAjCACsIMwjAMQhK4oQQgrmXoJ84QrgbzOhIUIOra9EkN9K/h4XM/92N3ryPJfb+pwfgrvZNX83fPvj+6fKsH88/WddXfunVf3y+5fZ/zZ3v3n2v//XfXb6n7==


formula: Ca9.5 Cu.26 Mg.8 Al5.44 Si9 O36.3 (F2.7 H2.3)
compound: <missing>
formula_title: <missing>
a: 15.517
b: 15.517
c: 11.781
alpha: 90
beta: 90
gamma: 90
cell_volume: 2836.597
crystal_density: 3.397
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
pub_title:
 Crystal chemistry of vesuvianite: Site preferences of square-pyramidal
 coordinated sites
 sample #1 from Sauland

atoms_sites:
["Ca1", "Ca2", "Ca3", "CaC", "CuB", "MgB", "Mg", "Al", "AlA", "Si1", "Si2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O-H10", "F10", "O-H11", "F11"]

atoms_x:
wMYtAFB19P8Qzvn/wMYtAMDGLQDAxi0AwCP5/8Aj+f8AAAAAwMYtAODz9P+Q7fr/sKPy/wDf+P/wA/3/0Dj8/zCe9f8wvvj/kGwDACBN/P8QK/f/wMYtAMDGLQAguP//ILj//w==

atoms_y:
QEIPADC0AgBgAPX/wMYtAMDGLQDAxi0AMGQHADBkBwAAAAAAQEIPAGB6AgDAy/b/4IgKABC5CQDwhA0AEIAGABDvAABAbO//0JMKAEB1+v8QK/f/wMYtAMDGLQCQ0AMAkNADAA==

atoms_z:
QEIPALApFwAgNjYAQLcIAHBQAwBwUAMAkLgHAJC4BwAAAAAAAAAAANAnNQAARBYAoDwFAAD+EABwrgQAsLocAEDdCgCgkwMAwJoTAPALBABAQg8AQPQ0AED0NAAgUAgAIFAIAA==

atoms_occupancy:
AAk9AAAJPQAACT0AgIQeAIDeDwAApg4AgIsIAIB9NAAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AgKIZAIBmIwDArxwAQFkgAA==

qdat:
AAAAAAAAAEAQAEAAAFAQQIYAABQlCQSAIGJkRI2IMEywSySijkjJUt43DMsluYnmrG9ud1z27WVLuu7ou9HqbH7nxpZ5j/ivCzioFfaIpC0FIMwXFAhAAUCgAgACgAAAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca9.5 Fe1.26 Al5.24 Si9 O38 F H4
compound: <missing>
formula_title: <missing>
a: 15.606
b: 15.606
c: 11.825
alpha: 90
beta: 90
gamma: 90
cell_volume: 2879.946
crystal_density: 3.405
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
pub_title:
 Crystal chemistry of vesuvianite: Site preferences of square-pyramidal
 coordinated sites
 sample #2 from Sanpo

atoms_sites:
["Ca1", "Ca2", "Ca3", "CaC", "FeB", "Al", "Fe", "AlA", "Si1", "Si2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "F10", "O-H11"]

atoms_x:
wL3w/+B29P9g+/n/wMYtAMDGLQAgLfn/IC35/wAAAADAxi0AAPf0/yDv+v+Qh/L/cN34/xAH/f+gQPz/8Jf1/0DM+P+QbAMAcEj8/1Ax9//Axi0AgMH//w==

atoms_y:
QEIPANCqAgDwGvX/wMYtAMDGLQDQWgcA0FoHAAAAAABAQg8AIHQCAFDN9v9wigoAIMcJAACTDQBAeAYAkOIAAIBy7/+QpgoAgHv6/1Ax9//Axi0AoMUDAA==

atoms_z:
QEIPALApFwDwCzYAMEUIAEBxAwBgwAcAYMAHAAAAAAAAAAAAMDE1ADA8FgBgNgUAkBgRALCbBAAwrhwAIPMKAGCmAwDQqBMAoBAEAEBCDwCw+DMAUEgIAA==

atoms_occupancy:
AAk9AAAJPQAACT0AgIQeAICEHgBAcDEAwJgLAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

qdat:
AAAAAAAAAEAQAEAAAKAgQQwAABhKEgkAQMTIiRsQYJFhlFmFKKGU5SxOMyxW5icbsam7mqvfda5tervE+8bps72dHnHuX8m8NaUgn5SFMOQlBkC5IEIACgUAEAAoAAAAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca9.5 Fe1.02 Al5.48 Si9 O35.93 (F3.07 H1.93)
compound: <missing>
formula_title: <missing>
a: 15.583
b: 15.583
c: 11.801
alpha: 90
beta: 90
gamma: 90
cell_volume: 2865.635
crystal_density: 3.415
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
pub_title:
 Crystal chemistry of vesuvianite: Site preferences of square-pyramidal
 coordinated sites
 sample #3 from Jinmu

atoms_sites:
["Ca1", "Ca2", "Ca3", "CaC", "FeB", "Al", "Fe", "AlA", "Si1", "Si2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O-H10", "F10", "O-H11", "F11"]

atoms_x:
wL3w/zBy9P/Q4Pn/wMYtAMDGLQBQJfn/UCX5/wAAAADAxi0AIPr0/9Dz+v+AkvL/ENT4/3AQ/f/QOPz/EJv1/9DN+P9QZgMAAEr8/xAr9//Axi0AwMYtAFDJ//9Qyf//

atoms_y:
QEIPABCxAgDACfX/wMYtAMDGLQAQYQcAEGEHAAAAAABAQg8A8HsCAODO9v8AjAoA4MAJADCLDQCAfgYAYOoAAABm7//giAoAYHj6/xAr9//Axi0AwMYtAIDCAwCAwgMA

atoms_z:
QEIPALApFwBAOTYAIJsIADBjAwCwuwcAsLsHAAAAAAAAAAAA8Co1AFA/FgDgQgUAgAoRAKCmBAAwrhwAIPMKAPCOAwBgkRMAgA0EAEBCDwCQpDQAkKQ0AABNCAAATQgA

atoms_occupancy:
AAk9AAAJPQAACT0AgIQeAICEHgDAGTUAQO8HAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQBAfgUAwIo3AIATHACA9SAA

qdat:
AAAAAAAAAEAQAEAAAGAgQIoAABhGEQkAQKJEhIsQIJlglklFHKGSpbxKGpRK9RObmN3V3Vnvq1cr36vSf6Ok0erfCrjuP+K2GuKQTcpDmGoSgyA6UCEABIKACAASAAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca9.5 Mg.26 Fe.36 Al5.88 Si9 O39 H5
compound: <missing>
formula_title: <missing>
a: 15.546
b: 15.546
c: 11.828
alpha: 90
beta: 90
gamma: 90
cell_volume: 2858.569
crystal_density: 3.364
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
pub_title:
 Crystal chemistry of vesuvianite: Site preferences of square-pyramidal
 coordinated sites
 sample #4 from Chichibu

atoms_sites:
["Ca1", "Ca2", "Ca3", "CaC", "MgB", "FeB", "Al", "Fe", "AlA", "Si1", "Si2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O-H10", "O-H11"]

atoms_x:
wL3w/8Bz9P8w0fn/wMYtAMDGLQDAxi0AUCX5/1Al+f8AAAAAwMYtAJD49P8Q4fr/sIry/zDX+P+AHv3/oED8/yCQ9f/Ajfj/8FwDAEBQ/P8QK/f/wMYtAFDJ//8=

atoms_y:
QEIPAJC9AgCw4vT/wMYtAMDGLQDAxi0AMGQHADBkBwAAAAAAQEIPAJCLAgBQzfb/cIoKALDICQCQlA0AAHIGANDPAAAgUO//EGgKALBz+v8QK/f/wMYtAJC3AwA=

atoms_z:
QEIPACAoFwAwXTYAYB4JAFA6AgBQOgIAoK0HAKCtBwAAAAAAAAAAAKAvNQBQPxYAAC0FAFASEQCwmwQAgKkcACDaCgBQfwMA0I8TAHAYBABAQg8AkNY0ALBRCAA=

atoms_occupancy:
AAk9AAAJPQAACT0AgIQeAIDeDwAApg4AQDQ7AMDUAQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

qdat:
AAAAAAAAAEAQAEAAAGAgQIwAABgqEQUAQKJoiJWIUIjQ1k2CnJHK5b5vGQ4tcpLdWZ+tbrlt2pq3btvhv8Wo8LfNWlnnN+H+FOaQVroikJQUgzBakCEABQKACAASAAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: O24 Si8 Mg2.17 Fe2 Li.83 Na2.962 Ca.04 H2
compound: Kajlidongri manganese mine, Jhabua district, Madhya Pradesh, India
formula_title: <missing>
a: 9.822
b: 17.836
c: 5.286
alpha: 90
beta: 104.37
gamma: 90
cell_volume: 897.056
crystal_density: 3.149
pub_title:
 Leakeite, NaNa2(Mg2Fe2Li)Si8O22(OH)2, a new alkali amphibole from the
 Kajlidongri manganese mine, Jhabua district, Madhya Pradesh, India

atoms_sites:
["O1", "O2", "O3", "O4", "O5", "O6", "O7", "Si1", "Si2", "Mg1", "Fe1", "Mg2", "Fe2", "Li3", "Mg3", "Na4", "Ca4", "NaA", "Nam", "Na2", "H"]

atoms_x:
wLYGAAA6BwBgxgYA8BwWAOBGFQDA+BQAoF8UAMD3EACwmBEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAcG8CAAAAAADQQgsA

atoms_y:
EIYFANBICgAAAAAAgEgPAJDRBwAQSAcAAAAAAOBCBQAAcwoAAC0FAAAtBQBA9goAQPYKAAAAAAAAAAAAMN0QADDdEACAhB4AgIQeAOAWHQAAAAAA

atoms_z:
oCUNAEB1LAAQoioAMP4wACAwBQDguiMA8DQSAAD4EQAg8DAAgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAgIQeAICEHgAAAAAAIK0FAAAAAAAQBy8A

atoms_occupancy:
AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAPIrAAAXEQAAFxEAAPIrAMCoMgBAYAoAgNA7AIA4AQBA4TMAwFECAMBRAgAACT0A

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6ADgzAwAAEnoA

atoms_aniso_label:
["O1", "O2", "O3", "O4", "O5", "O6", "O7", "Si1", "Si2", "Mg1", "Fe1", "Mg2", "Fe2", "Li3", "Mg3", "Na4", "Ca4", "NaA", "Nam"]

atoms_aniso_u11:
IF0AALByAADYpAAAaOwAAFBkAACwcgAAeJYAACBdAADATgAA4HkAAOB5AAAgXQAAIF0AANikAADYpAAAKAkBACgJAQBQoAUA6AUDAA==

atoms_aniso_u22:
GJcAABiXAADwfQAAyGQAAGjJAABoyQAAeEsAAHhLAAB4SwAAQLAAAECwAAB4SwAAeEsAAHhLAAB4SwAAQLAAAECwAACQ4gAA+JIBAA==

atoms_aniso_u33:
IKgAAFisAABQ5gAAOMcAABiNAACAegAAODUBALBjAADAZwAAkH4AAJB+AABAdAAAQHQAANiGAADYhgAACEwBAAhMAQBQQAYAiLsCAA==

atoms_aniso_u12:
kPL//3ANAABAyv//sNf//3ANAAAAAAAAAAAAAAAAAACQ8v//AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

atoms_aniso_u13:
OBMAACAXAAA4EwAAoEEAACAXAAA4EwAACBsAAHgPAAA4EwAAQC4AAEAuAAAgFwAAIBcAAFj4//9Y+P//mK0AAJitAADwyAUAsD4CAA==

atoms_aniso_u23:
0Pj//+gcAADQ+P//AAAAAKAyAACQ1P//AAAAAND4//8AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

qdat:
AAAAAAAAAAACEAAAAAAAFAgGAgQAAAA4QEAUAEBADkEIwMEwKBAxqiwIYDDEBY+GIWg6SJRcAJjFNNNgAjmCnZL8p1S0RmrT2ZgT7MqoxDW80d6zcSAdNVmfA16QOj1yjpmo1A347BTcTAWaLkctIYSgm0bmEeAT4SBOoV==


formula: Ca Mn Al4 Si P3 O20 H5
compound: <missing>
pub_title: Attakolite: New data and crystal-structure determination
formula_title: <missing>
a: 17.188
b: 11.477
c: 7.322
alpha: 90
beta: 113.83
gamma: 90
cell_volume: 1321.250
crystal_density: 3.263
atoms_occupancy: 0
atoms_sites:
["Ca", "Mn", "Al1", "Al2", "Si", "P1", "P2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O11", "O12", "O13", "O14", "H1", "H2", "H3", "H4"]

atoms_x:
AAAAAGCEEQCQHAgAYEMHALAkAwCAdxwA4McMAEDUGABQsBgA8Kb//7BsEABQ/w8AUPEJAEDJBQDA6B8AsIMIAKCtBwCgzQoAQGUFAKBvCQDgsBQAQKApAODfIQAARwkA

atoms_y:
ANIPAAAAAABgZhYAwOIHAAAAAAAAAAAAYHcPAAAAAAAAAAAAkBL5/wD8CACgCBYAYLwQAAAAAABQV/n/MCEOAAAAAACAhB4AgOQOAAAAAACAhB4AAAAAAMA08v8AAAAA

atoms_z:
AAAAAID6AgBATB4A0OcuAMAwFABQVg4AwOMLAMCOFQAQCAEAoBkPAKD6DwDQjQsAkB8UAEDz5f9gaxEAcB3//2CpDwBArxoAkHQjAHBI/P9gaOz/IMoVAMAgHwAgSAEA

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegDA1AEAwNQBAMDUAQDA1AEA

atoms_aniso_label:
["Ca", "Mn", "Al1", "Al2", "Si", "P1", "P2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O11", "O12", "O13", "O14"]

atoms_aniso_u11:
UKoAAGBUAADwbgAAQGoAAOBgAABQXwAAgFcAAAB9AABAnAAAkH4AAGBtAACwgQAAYLgAAOCrAABwewAA4HkAAGDqAACAuwAAsE8AAECcAAA=

atoms_aniso_u22:
IOQAAEC1AACgWgAAwF0AAFBfAADwbgAAEFkAAIC7AABAGQEAIIAAAIBwAADAdgAAgKIAAGBtAADAdgAAAJYAAIA4AQCgjAAAUKoAAGBtAAA=

atoms_aniso_u33:
0J0AAFDDAADwbgAAAGQAABBZAABgbQAAwF0AAOCrAAAAfQAAMI4AABByAAAArwAA8LkAAKCMAACQsAAAoHMAAIC7AACgjAAAYG0AAMBdAAA=

atoms_aniso_u12:
AAAAAAAAAADw8f//oPb//wAAAAAAAAAAcP7//wAAAAAAAAAA4Pz//1AUAACg9v//oPb//wAAAACgDwAAYAkAAAAAAAAAAAAAUOL//wB9AAA=

atoms_aniso_u13:
cGIAAFAUAAAwKgAAgCUAAEAfAADgLgAAECcAAIBXAAAwKgAA4C4AAEAfAAAQQAAAQIMAAIA+AAAgNQAAIBwAAKCMAABgbQAAQAYAAIA+AAA=

atoms_aniso_u23:
AAAAAAAAAABgCQAAAAAAAAAAAAAAAAAAUPv//wAAAAAAAAAAUPv//zD4//8QDgAAAOf//wAAAABw/v//QO3//wAAAAAAAAAAcBcAAAAAAAA=

qdat:
AAAAAAAAAAAIAIACAAQAAIiAoACAQAIIIFEC0ADCsACRoQREmFZZAa1COwCFDImg1VWjUgVpv1aYu61dqefy8K5GSgKX9z6vU0pavWL5Qzd8T1avO85t1uBMderV7xFp9VNkdobt+xkyRH2jNpS1Fu/krLFjfW2eEsRTie==


formula: Cu3 Ca6 S3 O26
compound: Wessels mine, South Africa
formula_title: <missing>
a: 15.122
b: 14.358
c: 22.063
alpha: 90
beta: 108.68
gamma: 90
cell_volume: 4538.010
crystal_density: 2.761
atoms_occupancy: 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
pub_title:
 Description and crystal structure of vonbezingite, a new Ca-Cu-SO4-H2O mineral
 from the Kalahari manganese field, South Africa

atoms_sites:
["Cu1A", "Cu1B", "Cu2A", "Cu2B", "Cu2C", "Cu2D", "Ca1A", "Ca1B", "Ca1C", "Ca1D", "Ca2A", "Ca2B", "Ca2C", "Ca2D", "Ca3A", "Ca3B", "Ca3C", "Ca3D", "S1A", "S1B", "S1C", "S1D", "S2A", "S2B", "O1A", "O1B", "O1C", "O1D", "O2A", "O2B", "O2C", "O2D", "O3A", "O3B", "O3C", "O3D", "O4A", "O4B", "O4C", "O4D", "O5A", "O5B", "O5C", "O5D", "O6A", "O6B", "O6C", "O6D", "O7A", "O7B", "O7C", "O7D", "O8A", "O8B", "O8C", "O8D", "O9A", "O9B", "O9C", "O9D", "O10A", "O10B", "O10C", "O10D", "O11A", "O11B", "O11C", "O11D", "O12A", "O12B", "O13A", "O13B", "O14A", "O14B", "O15A", "O15B"]

atoms_x:

atoms_y:

atoms_z:

atoms_u_iso:

qdat:
AAAAAAAIBAoAMAWEqCIA6ss21w9DZ71xnb3PVb3e//n7/q/v+/+/3/f+/+/9/////////733///////+/////7v///33v973//f/H+3L971vjcyTQVkQOEAkECAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Cu Cl2
compound: <missing>
pub_title: Tolbachite, CuCl2, the first example of Cu2+ octahedrally coordinated by Cl
formula_title: <missing>
a: 6.9038
b: 3.2995
c: 6.824
alpha: 90
beta: 122.197
gamma: 90
cell_volume: 131.540
crystal_density: 3.395
atoms_sites: ["Cu", "Cl"]
atoms_x: AAAAAIDPHgA=
atoms_y: AAAAAAAAAAA=
atoms_z: AAAAAGAADgA=
atoms_occupancy: 0
atoms_u_iso: 6GIAAPjFAAA=
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:
AAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAAAABMAAAAAAABAAAgAAAAAIAABAAAAEUAAgAAAACHwAAAAAGAABCAIAAAMCAAAAhlAABIBAAIIREBICAABAWAEQAAAAFBAqiIEOVgAQCAAYiApkIQzwBQSAECBAAhEL2AhQQMT==


formula: Mn5 Si2 O10 H2
compound: <missing>
pub_title: Ribbeite, a second example of edge-sharing silicate tetrahedra in the leucophoenicite group
formula_title: <missing>
a: 10.732
b: 15.672
c: 4.811
alpha: 90
beta: 90
gamma: 90
cell_volume: 809.171
crystal_density: 4.046
atoms_sites: ["Mn1", "Mn2", "Mn3", "Si1", "Si2", "O1", "O2", "O3", "O4", "O5", "O6", "H1", "H2"]
atoms_x: UAI1ACAWJADQTicAsHovANAnHACALBwAIHkvADAGOABQVysAYEMgAND5EgDg3yEAoA4VAA==
atoms_y: yNkIAEBCDwBYvQMAQEIPAAC8AgAAowIAQEIPAEBCDwCQQgoAUGEIAPCtAgDAsAcAQBMCAA==
atoms_z: cBweAOhmHwBAwP//gFgEADCdIwAATxAA0AwtAFD4DAAw9QwAcJ8sAADTLACguiIAAJ8kAA==
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQCAhB4AgIQeAA==
atoms_u_iso: sNsAALDbAABQ9QAA6GwAAJiAAABo8QAAiJAAAGCaAABwlAAAqDgBABgPAQBoUAEAyIsBAA==
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:
AAAAAAAAAAAAAIAAAAAECABDBACIgSgQQQAFEgDnQyAFKUGKQmCrlFSzxgV6hhdxqK7I8mL3h85jfaq5O92tlvijzP9nT/uXOn177by+w952a/fuvffnO/f+8j7HbZsK+4r3+P34elg3/ZsbdkbsmqkVfP275die/7a904==


formula: B1.632 Si3.368 Al5 Mg2 (Ca1.598 Na.402) O20
compound: <missing>
formula_title: <missing>
a: 10.010
b: 10.393
c: 8.631
alpha: 106.37
beta: 96.10
gamma: 124.38
cell_volume: 669.890
crystal_density: 3.416
atoms_u_iso: 0
pub_title:
 Cation occupancies in serendibite: A crystal structure study
 Sample from Johnsburg, New York
 Displacement parameters obtained from ICSD

atoms_sites:
["B1", "Si1", "Si2", "Al3", "B4", "Si4", "Si5", "Si6", "Al1", "Al2", "Al3", "Al4", "Mg5", "Mg6", "Al7", "Ca8", "Na8", "Ca9", "Na9", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "O20"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_aniso_label:
["B1", "Si1", "Si2", "Al3", "B4", "Si4", "Si5", "Si6", "Al1", "Al2", "Al3", "Al4", "Mg5", "Mg6", "Al7", "Ca8", "Na8", "Ca9", "Na9", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "O20"]

atoms_aniso_u11:

atoms_aniso_u22:

atoms_aniso_u33:

atoms_aniso_u12:

atoms_aniso_u13:

atoms_aniso_u23:

qdat:
AAAAAAAAAAAAAEAAAAAAAAiAQABAAAAAQBCABAAAIAAhQQGEEBAAAHgsJgAGFAAgExgfAZAADHBRY4IVeApAAk2tYfIsC4wkznGeYlixgC5urZp6Di0MPCb+Zyv+UE1ul3wrPOfs9AK9/b/+3/2/k/Pfvtn/31fh/j3u9h==


formula: (Si14.52 Al3.48) O48.2 Na.96 Ca.784 Ba.16 K.28 Mg.36 H12.2
compound: <missing>
formula_title: <missing>
a: 17.622
b: 17.895
c: 7.399
alpha: 90
beta: 116.45
gamma: 90
cell_volume: 2089.007
crystal_density: 2.194
pub_title:
 Dehydration mechanism of clinoptilolite and heulandite: Single-crystal X-ray
 study of Na-poor, Ca-, K-, Mg-rich clinoptilolite at 100 K
 Sample Natural
 Data obtained from the ICSD

atoms_sites:
["Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "Na", "Ca", "Ba", "K", "Mg", "O-H11", "O-H12", "O-H13", "O-H14", "O-H15", "O-H16", "O-H17", "O-H18", "O-H19"]

atoms_x:
kPEKAJDxCgBQdhEAUHYRABDtEQAQ7REAgPQDAID0AwAAAAAAAAAAAOBxEgBQCw4AsCYLACBeDgAAAAAAcPkEAED5FgBAgwAAwA8NABBIBwDgrQgAgPobAAAjDwAAIw8AAAAAAGBlKwAA3AUAYJ8ZAAAAAACgkv//gK8CAADbGgAgKgYA4CcWAA==

atoms_y:
AFoKAABaCgBQcwUAUHMFAGDiEgBg4hIAEFESABBREgAwQA0AMEANAAAAAACgYgcAoG8JAGBiBgAgCBQAMO4JAOBLEAAAgRAAUGkPADC5FgAAAAAAAAAAAICEHgCAhB4AAAAAAAAAAAAAAAAA0BU4AICEHgBgMAYAAAAAAEBxHAAAAAAAAAAAAA==

atoms_z:
kPYFAJD2BQCwYx4AsGMeAIBuEQCAbhEAwCsZAMArGQAAAAAAAAAAAPA+IQCQNiUAIPv4/0B0DwCAhB4AEN0DAICWGwCgMQsAID4LAHDMGACgLCkAMOUwAGBbAwBgWwMAgIQeACBjOwAA2i8AwB8CAICEHgAg+SIAAOIEAMDeKQAA1gYAALgLAA==

atoms_occupancy:
ANQwAAA1DACAuSoAgE8SAMCoMgBAYAoAAEUzAADECQAAJzgAAOIEAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAATB0AAO0XAADiBACAiwgAAPkVAIBPEgAACT0AAAk9AAAJPQBABhkAQFkgAIBPEgDAmAsAAMQJAA==

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegBADQMAgBoGAAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AA==

atoms_aniso_label:
["Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "Na", "Ca", "Ba", "K", "Mg", "O-H11", "O-H12", "O-H13", "O-H14", "O-H15", "O-H16", "O-H17"]

atoms_aniso_u11:
AJYAAACWAAAwwAAAMMAAAIC7AACAuwAA4KsAAOCrAAAgmQAAIJkAAMDUAQAA9AEAYGECAAB3AQCgAwIAYOoAACDFAQCghgEA4CgBAMBXAQCgAwIAIEgBAEB+BQBAfgUAgLUBAABxAgCAiwgAILMEAMDCBAAA4gQAwD4aAACIEwA=

atoms_aniso_u22:
0OgAANDoAADQnQAA0J0AAPDSAADw0gAAcN8AAHDfAABw3wAAcN8AAGDqAADgpQEAgLUBAECWAQAgxQEAgDgBAEATAgAA9AEAIEgBAGBnAQDA2gAAQJYBAIA4AQCAOAEAYOoAAMC2BgCgdAQAIDwDAMBRAgBAfgUAwNQBAACmDgA=

atoms_aniso_u33:
QJwAAECcAADAwQAAwMEAAOCSAADgkgAAEKQAABCkAABQqgAAUKoAAGBnAQAA9AEAwFcBAOAoAQBg5AEA4KUBAMDUAQDAVwEAwNQBAAD0AQCAMgIAAHECAMBFBADARQQAAOgDAEANAwAAJzgA4JMEACAeCABA7wcAANQwAAAXEQA=

atoms_aniso_u12:
wPn//8D5///QBwAA0AcAACADAAAgAwAAMPj//zD4//8AAAAAAAAAAAAAAACAwf//gMH//6CMAAAAAAAAYPD//+CrAACgDwAAQKL//6CS//8AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAwF0AAAAAAAAAAAAAAAAAAAA89v8=

atoms_aniso_u13:
cEkAAHBJAAAQWQAAEFkAAKBaAACgWgAAsE8AALBPAACgQQAAoEEAAKCMAADAVwEAIEgBACBOAAAAdwEAAH0AACBOAAAAfQAAIMsAAIC7AABAnAAAwF0AAICpAwCAqQMAAH0AAECcAACAdPf/YOoAAADuAgAAcQIAQMoiAICpAwA=

atoms_aniso_u23:
MBEAADARAAAgAwAAIAMAALAEAACwBAAAIAMAACADAAAAAAAAAAAAAAAAAAAAg///AAAAAKAPAAAAAAAAoA8AAECcAAAgVP//AIP//8Dg//8AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAwOD//wAAAAAAAAAAAAAAAIAaBgA=

qdat:
AAAAAAAABAACAIABACBCFAAIBANIQggiACgcEEMZAkQoyHRWDuLiDzrLcBk8rX7fJxuv3wdRvxv6fFu7wyWCt9/RerAvOlv/BO+moVafyr2My9TPq+h2g/XGZg9RqY0qWnixdPBIinI9NIPiaUONOy8grrkjcGsbB61Rvi==


formula: (Si14.52 Al3.48) O39.36 Na.56 Ca.444 Ba.16 K.84 H3.36
compound: <missing>
formula_title: <missing>
a: 17.588
b: 17.572
c: 7.389
alpha: 90
beta: 116.77
gamma: 90
cell_volume: 2038.863
crystal_density: 1.988
pub_title:
 Dehydration mechanism of clinoptilolite and heulandite: Single-crystal X-ray
 study of Na-poor, Ca-, K-, Mg-rich clinoptilolite at 100 K
 Sample Dehyd 1
 Data obtained from the ICSD

atoms_sites:
["Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "Na", "Ca", "Ba", "K1", "K2", "K3", "O-H11", "O-H12", "O-H13", "O-H14"]

atoms_x:
MAELADABCwBQ8xEAUPMRAHCSEQBwkhEAMPkDADD5AwAAAAAAAAAAAPBHEwAgwg4AUIELAKCcDgAAAAAAQAEFAPCZFgBAtQAAMNwMAJDwBgDg5gsAgEUcAFC6DgBQug4AwAkOAGAfDQDgEAUAoG0aAAAAAAAgKgYA

atoms_y:
8BkKAPAZCgAAeAUAAHgFAPAVEwDwFRMAsMoRALDKEQAwqgwAMKoMAAAAAAAwMgcAgO8IAGBJBgBwVBMAkGEJAACaEADw9Q8AUGkPAJB3FgAAAAAAAAAAAICEHgCAhB4AAAAAAAAAAAAAAAAAwAc4AICEHgAAAAAA

atoms_z:
4NgFAODYBQBA4h4AQOIeAGDVEABg1RAAQDgZAEA4GQAAAAAAAAAAAADjIQCgVyYAMDv5/3DpDwCAhB4AMGMDAHBvGwAgVwsAgE0KAGClGAAAYy4AgKctAKB6AwCgegMAIFT//4CLCADAljUAIEICAICEHgAA1gYA

atoms_occupancy:
ANQwAAA1DACAuSoAgE8SAMCoMgBAYAoAAEUzAADECQAAJzgAAOIEAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAAFxEAwIwNAADiBABAJBQAgKkDAMDUAQAA+RUAQAYZAIDXJQDAmAsA

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AEANAwAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAQA0DAEANAwAAEnoAABJ6AAASegAAEnoA

atoms_aniso_label:
["Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "Na", "Ca", "Ba", "K1", "O-H11", "O-H12", "O-H13"]

atoms_aniso_u11:
0M8AANDPAACAagEAgGoBALBJAQCwSQEA0BoBANAaAQDwBAEA8AQBAIAmBAAA6AMAAHECAECWAQAA4gQAoAkBAGDeAgAgvwIAYOQBACBCAgBAfgUAwM4CAEByBwBAcgcAAOIEAADbGgCA/AoA

atoms_aniso_u22:
cMABAHDAAQAQIQEAECEBAGCZAQBgmQEAoNEBAKDRAQCwlAEAsJQBAGBnAQAguQMAYN4CACC/AgBAhAQA4CICAKD9AgAgPAMAIMUBAEANAwCAOAEAQIQEAOAoAQDgKAEAAHECAEDvBwCAiwgA

atoms_aniso_u33:
YBwBAGAcAQBQWQEAUFkBAEAZAQBAGQEAoCIBAKAiAQDADAEAwAwBAICvAgCg9wMAwNQBAIC1AQBgVQQAAHECAOAcAwDA1AEAIEICAGDeAgAA4gQAQA0DAGBPBQBgTwUAgIsIAABTBwAApg4A

atoms_aniso_u12:
8Nj///DY//+g9v//oPb//1D7//+wSQEAYNf//2DX//8AAAAAAAAAAAAAAADAY///QCX//2BtAAAAAAAAAAAAAECcAACgDwAAAIP//8Dm/v8AAAAAAAAAAAAAAAAAAAAAAAAAAMC2BgAAAAAA

atoms_aniso_u13:
0IQAANCEAADgxAAA4MQAAGC4AABguAAAAJYAAACWAADwbgAA8G4AAAD6AADgHAMAgDgBAMBdAACAJgQAYOoAAIDB//9AnAAAwFcBACDLAACAqQMA4LH//+CTBADgkwQAwGP//8AQ+P+AiwgA

atoms_aniso_u23:
wBIAAMASAACQAQAAkAEAALAEAACwBAAA0O7//9Du//8AAAAAAAAAAAAAAABAqP7/QKL//2BtAAAAAAAA4C4AACBIAQAg1/7/4LH//0AfAAAAAAAAAAAAAAAAAAAAAAAAAAAAAMDy/P8AAAAA

qdat:
AAAAAAAAAgAAgIABABAhDAABAgDKCQERABkHCBUWgJKKDAcjgdqZQPi5wYUnZr68WPGtH+l3Dcr2ZaP9skrIU3z3C9MA86M1mJfarhnqXJvclLVXebcGuC6LXSBml5xms1LJju2CzwrTZnR7DcSad5D5A/D1DcPYfC5Ztb==


formula: (Si14.52 Al3.48) O38.58 Na.42 Ca.22 Ba.16 K1.06 H2.58
compound: <missing>
formula_title: <missing>
a: 17.619
b: 17.503
c: 7.371
alpha: 90
beta: 116.71
gamma: 90
cell_volume: 2030.552
crystal_density: 1.968
pub_title:
 Dehydration mechanism of clinoptilolite and heulandite: Single-crystal X-ray
 study of Na-poor, Ca-, K-, Mg-rich clinoptilolite at 100 K
 Sample Dehyd 2
 Data obtained from the ICSD

atoms_sites:
["Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "Na", "Ca", "Ba", "K1", "K2", "O-H11", "O-H12", "O-H13", "O-H14"]

atoms_x:
8PoKAPD6CgCg7hEAoO4RACCXEQAglxEAkAIEAJACBAAAAAAAAAAAAGAtEwBw1g4AcJ0LALB4DgAAAAAAcPkEAHCmFgCA1AAAcPsMAGARBwAAsgwAANUbAKDnDgCg5w4AgG0NAMA/BQCAKxgAAAAAAEB4BgA=

atoms_y:
IBIKACASCgDgdAUA4HQFADAcEwAwHBMAcMQRAHDEEQBguwwAYLsMAAAAAAAQLwcAsM4IALArBgBgRhMAkHoJABDBEACQBRAA4FEPAPBnFgAAAAAAAAAAAICEHgCAhB4AAAAAAAAAAAAAJzgAgIQeAAAAAAA=

atoms_z:
MNQFADDUBQCg0h4AoNIeAPDWEADw1hAA4GAZAOBgGQAAAAAAAAAAAODfIQBAgCYAQGL5/6D6DwCAhB4AQCYDALBcGwAwfgsA0GEKAABLGQCAGDAAAG8sADDgAwAw4AMAQJwAAMATNgDgkwQAgIQeAMC2BgA=

atoms_occupancy:
ANQwAAA1DACAuSoAgE8SAMCoMgBAYAoAAEUzAADECQAAJzgAAOIEAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQBA0QwAwLYGAADiBADAPhoAgBoGAMB6EADAzRcAAGoYAABxAgA=

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AEANAwAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAQA0DAAASegAAEnoAABJ6AAASegA=

atoms_aniso_label:
["Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "Na", "Ca", "Ba", "K1", "O-H11", "O-H12", "O-H13"]

atoms_aniso_u11:
gO0AAIDtAADA1AEAwNQBAFCkAQBQpAEAMFYBADBWAQDgKAEA4CgBAIAgBQBAAQUAwM4CACDFAQCAGgYA4CgBAOCZAwAgPAMAgDICAKCAAgDAJwkAQA0DAKDrBQCg6wUAAHECAIDeDwAAxAkA

atoms_aniso_u22:
MGkCADBpAgCwYgEAsGIBADAeAgAwHgIAUGwCAFBsAgCgAwIAoAMCAECWAQCAIAUAgKkDAMDIAwBA+wUA4J8CAICpAwCg9wMAAHECAOCZAwCAOAEAQA0DAGBnAQBgZwEAwEUEAIAjQwCAGgYA

atoms_aniso_u33:
YE4BAGBOAQAwoQEAMKEBAEBkAQBAZAEAgFEBAIBRAQAgSAEAIEgBAOCZAwAA4gQAAPQBAMBRAgAgKgYA4BwDACA8AwDgIgIAYGECAMDIAwAAUwcAwEUEAGBPBQBgTwUAAMQJAAAuIgCAwBQA

atoms_aniso_u12:
ENz//xDc//8Q9f//EPX//+Dj///g4///wK7//8Cu//8AAAAAAAAAAAAAAADA5v7/AAb//yBOAAAAAAAAwOD//wB9AAAgTgAAIFT//yDX/v8AAAAAAAAAAAAAAAAAAAAAAAAAAAAH6v8AAAAA

atoms_aniso_u13:
0IQAANCEAACg8AAAoPAAALDlAACw5QAAQLUAAEC1AACAcAAAgHAAAAB9AAAA6AMAAHcBAAB9AACAnQUA4CgBACDR//8AfQAAYGcBAMDaAACAGgYAQJwAAKD9AgCg/QIAwGP//4AD9f+A/AoA

atoms_aniso_u23:
kBoAAJAaAAAQ9f//EPX//4Dz//+A8///EMP//xDD//8AAAAAAAAAAAAAAAAg3f3/YHP//8DaAAAAAAAA4C4AAAB3AQCAOAEAIE4AACBOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABqGAAAAAAA

qdat:
AAAAAAAAAgAAgIABABARDAAAhADKCQCRABkFiBMLAKJKCgMjgTGZQe/rIMYT5Z+6bOk1nvXyj0WmlrNW80zwTL99i9EA3VOX2Fffbwl1V5nUVp3NvZODchdNubBWVbdZWnGkQ+bB50XxnzkbhePNKex0gLwphmHkNhc61t==


formula: (Si14.52 Al3.48) O38.42 Na.38 Ca.16 Ba.16 K1.08 H2.42
compound: <missing>
formula_title: <missing>
a: 17.610
b: 17.456
c: 7.360
alpha: 90
beta: 116.77
gamma: 90
cell_volume: 2019.978
crystal_density: 1.970
pub_title:
 Dehydration mechanism of clinoptilolite and heulandite: Single-crystal X-ray
 study of Na-poor, Ca-, K-, Mg-rich clinoptilolite at 100 K
 Sample Dehyd 3
 Data obtained from the ICSD

atoms_sites:
["Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "Na", "Ca", "Ba", "K1", "K2", "O-H11", "O-H12", "O-H13", "O-H14"]

atoms_x:
gPwKAID8CgAA+BEAAPgRAOCQEQDgkBEAIAQEACAEBAAAAAAAAAAAAIAwEwAQ5g4AsKMLANB7DgAAAAAA4PcEAFCjFgDA2gAAkP4MAIAUBwDADw0AwLUbAIDkDgCA5A4AgG0NAIAgBQAA7RcAAAAAAIAUBwA=

atoms_y:
wAgKAMAICgBQcwUAUHMFAOAgEwDgIBMAgLkRAIC5EQAgtQwAILUMAAAAAADwKwcA8LsIAFAiBgCgMxMAUHQJAADMEABQ/w8AEEoPAJBeFgAAAAAAAAAAAICEHgCAhB4AAAAAAAAAAABARjgAgIQeAAAAAAA=

atoms_z:
oNIFAKDSBQBw2h4AcNoeAADMEAAAzBAA0GsZANBrGQAAAAAAAAAAAIDvIQCQlCYAEGr5//AOEACAhB4AMBgDAJBZGwDQdAsAUFUKANBrGQAA1DAAwNIrAADoAwAA6AMAQJwAAKC/NgDARQQAgIQeAEDvBwA=

atoms_occupancy:
ANQwAAA1DACAuSoAgE8SAMCoMgBAYAoAAEUzAADECQAAJzgAAOIEAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQDAmAsAAOIEAADiBACAExwAAOIEAEDRDABAlRYAAGoYAICpAwA=

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AEANAwAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAQA0DAAASegAAEnoAABJ6AAASegA=

atoms_aniso_label:
["Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "Na", "Ca", "Ba", "K1", "O-H11", "O-H12", "O-H13"]

atoms_aniso_u11:
QAABAEAAAQBw8gEAcPIBAHDZAQBw2QEAIHoBACB6AQCAOAEAgDgBAGBPBQAgMAUAAO4CAKADAgAgpwYAYGcBAMDIAwCgegMAYGECAGDeAgDAtgYAgKkDAMA/BQDAPwUAwNQBAADECQCA/AoA

atoms_aniso_u22:
gK8CAICvAgCQkQEAkJEBAABxAgAAcQIAIL8CACC/AgDAUQIAwFECAMDUAQCAnQUAAOgDACA2BADghwYAYN4CAEAHBADARQQAQJACAADoAwDA1AEAQA0DAKCGAQCghgEAgBoGAIBYTwDAJwkA

atoms_aniso_u33:
kHgBAJB4AQAw0wEAMNMBAICcAQCAnAEAoG0BAKBtAQAAdwEAAHcBAIAmBAAAXwUA4CICAABxAgAA1gYAoHoDAMBLAwAgQgIAgK8CACA2BACAGgYAwEUEAGDMBQBgzAUAgIsIAIC5KgCAwBQA

atoms_aniso_u12:
MN///zDf//+g9v//oPb//3DM//9wzP//wK7//8Cu//8AAAAAAAAAAAAAAABg9v7/wOb+/yBOAAAAAAAAINH//6CMAAAgTgAAgET//4DH/v8AAAAAAAAAAAAAAAAAAAAAAAAAAECj6v8AAAAA

atoms_aniso_u13:
wI8AAMCPAAAg/QAAIP0AAEAAAQBAAAEAEL0AABC9AADgeQAA4HkAAMBdAACAJgQAAHcBAAB9AACAGgYAwFcBAOCx//8gTgAA4KUBAAD6AACAqQMAQJwAACC/AgAgvwIAAAAAAEBn9P/AmAsA

atoms_aniso_u23:
8CMAAPAjAAAw+P//MPj//5Do//+Q6P//4Mr//+DK//8AAAAAAAAAAAAAAACgnv3/4KsAAAD6AAAAAAAAoA8AAAB3AQCgmP7/4LH//4A+AAAAAAAAAAAAAAAAAAAAAAAAAAAAAIC5KgAAAAAA

qdat:
AAAAAAAAAgAAgIAAgAgQjAAAggDGBQCRABiFiBKLgGFJBgOhgJmMoPbdoGMJ4s/WNnSvT6p7h/LTS/lbeWU4Jl++w7jAZqjPbDP/tYaqqsbuF07mVq3AmQem2mw1qdfsrJTxEOvgWZJkRs6HYWjzmXIPEG8eYeiZFcTKlZ==


formula: Na.814 K.014 Ca.009 Ti.03 Cr.006 Fe.612 Mn.003 Mg2.274 Al6.078 Si6 B3 (O34 H4)
compound: Osarar, Narok District, Kenya
formula_title: <missing>
a: 15.947
b: 15.947
c: 7.214
alpha: 90
beta: 90
gamma: 120
cell_volume: 1588.783
crystal_density: 3.211
atoms_u_iso: 0
pub_title:
 Reassignment of cation site occupancies in tourmaline: Al-Mg disorder in the
 crystal structure of dravite

atoms_sites:
["NaX", "KX", "CaX", "TiY", "CrY", "FeY", "MnY", "MgY", "AlY", "AlZ", "MgZ", "SiT", "B", "O-H1", "O2", "O-H3", "O4", "O5", "O6", "O7", "O8"]

atoms_x:
AAAAAAAAAAAAAAAAuEo5ALhKOQC4SjkAuEo5ALhKOQC4SjkA6BItAOgSLQAQczEAwLYGAAAAAACIugMAeBE1ACCtBQAIYTcAAMkxAMClKwDAkCwA

atoms_y:
AAAAAAAAAAAAAAAASL4DAEi+AwBIvgMASL4DAEi+AwBIvgMAaNsqAGjbKgB4VjEAQFI2AAAAAAB4TjkAiPcHAGhMNwD4pwUAUC4xAPCiKwDIQzAA

atoms_z:
gLcJAIC3CQCAtwkAMHEiADBxIgAwcSIAMHEiADBxIgAwcSIAoN8gAKDfIAAApDgAME8XAFCoKgDAXRkAUL0aAND3PABASwEAsBUrADBcAACgbBYA

atoms_occupancy:
wK4xAMDaAACgjAAAQJwAAEAfAACAcwwAoA8AAEB3GwDAYhQAwKIzAEBmCQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_aniso_label:
["NaX", "KX", "CaX", "TiY", "CrY", "FeY", "MnY", "MgY", "AlY", "AlZ", "MgZ", "SiT", "B", "O-H1", "O2", "O-H3", "O4", "O5", "O6", "O7", "O8"]

atoms_aniso_u11:
sGIBALBiAQCwYgEAoIwAAKCMAACgjAAAoIwAAKCMAACgjAAAEHIAABByAACAVwAAYIYAAADIAACg1wAAMNkAANCdAACQlwAA8LkAAMB2AAAgmQAA

atoms_aniso_u22:
sGIBALBiAQCwYgEAoIwAAKCMAACgjAAAoIwAAKCMAACgjAAA0GsAANBrAABgVAAAYIYAAADIAACg1wAAMNkAANCdAACQlwAA4KsAAGCGAADgYAAA

atoms_aniso_u33:
kBQBAJAUAQCQFAEAENYAABDWAAAQ1gAAENYAABDWAAAQ1gAA0GsAANBrAADQawAAIIAAAGC4AACgvgAA8G4AALCzAACgpQAAoHMAAACvAABw+AAA

atoms_aniso_u12:
ILIAACCyAAAgsgAA4C4AAOAuAADgLgAA4C4AAOAuAADgLgAAsDYAALA2AAAQJwAAUEYAAABkAAAwjgAAkBoAALAdAACQGgAAcGIAAGAiAABgOwAA

atoms_aniso_u13:
AAAAAAAAAAAAAAAAkBoAAJAaAACQGgAAkBoAAJAaAACQGgAAYPD//2Dw//9gCQAAQAYAAAAAAADQBwAAcP7//2Dw///Q7v//wBIAADAqAADgyv//

atoms_aniso_u23:
AAAAAAAAAAAAAAAAcOX//3Dl//9w5f//cOX//3Dl//9w5f//4Pz//+D8//9ABgAAwPn//wAAAAAw+P//kAEAAKAPAAAwEQAAgAwAANAgAABw5f//

qdat:
AAAAAAAAAAAAAQAAIAAAAgBABAIAAAggCCCIQAAJCAiEiEAJIUBREAEiEKGA0lIiYGpKUsEhw5YIUUrBU1wgo6ywyp1gxKqEGKQyALGMUxtUcxiKSSKdIfYqtw9FCj7G/EKry6QYFTqoFUlDYI/rJCiwKcMgVNAlgoQJoJ==


formula: Al2 Si O6 H2
compound: <missing>
pub_title: Synthesis, stability, and properties of Al2SiO4(OH)2: A fully hydrated analogue of topaz
formula_title: <missing>
a: 4.7238
b: 8.9473
c: 8.3900
alpha: 90
beta: 90
gamma: 90
cell_volume: 354.606
crystal_density: 3.373
atoms_sites: ["Al", "Si", "O1", "O2", "O3", "O-H"]
atoms_x: wDb6/7CHGABwUe7/oGEDAOASDQAQ9eb/
atoms_y: oBEIAFBe/P/QlwEA4JwPADCU///ATg8A
atoms_z: 4N4EAEBCDwBAQg8AQEIPAMC8BQAQDwQA
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Al", "Si", "O1", "O2", "O3", "O-H"]
atoms_aniso_u11: IJkAAKCMAACAiQAAwKgAANCdAACgpQAA
atoms_aniso_u22: EIsAAICJAABwlAAAYJ8AAECcAACgvgAA
atoms_aniso_u33: ENYAAJDiAABg6gAAYOoAAIDUAADwBAEA
atoms_aniso_u12: IAMAAAAAAACg9v//UPv//6APAADQIAAA
atoms_aniso_u13: IAMAAAAAAAAAAAAAAAAAAGAJAACQAQAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAGQAA
qdat:
AAAAAAAAAAAAAAAAAQAAAAAIAkAAgAAAAIUIAIAQBAAMIhhEEIxKQoCRkFgVABEFkiRLGURihEHkcWUxgUPwwXahfmZy1TwsfmnZbnPvd60mfxcn2z/9jvX/3v/7/5n7F9/9mud/n+6v9+n7pvvJXzt9X/0m731e/qT+nV==


formula: Ce C O3 F
compound: <missing>
formula_title: <missing>
a: 7.1175
b: 7.1175
c: 9.7619
alpha: 90
beta: 90
gamma: 120
cell_volume: 428.272
crystal_density: 5.098
atoms_sites: ["Ce", "C", "O1", "O2", "F1", "F2"]
atoms_x: SLcUAECnEwCASRMAUM4TAAAAAACrsCgA
atoms_y: AAAAAECzEQAgpwYAQF0XAAAAAABVWBQA
atoms_z: AAAAAEBCDwBAQg8AoEMIAAAAAADgHAMA
atoms_occupancy: 0
atoms_u_iso: QEcAAMB2AAAgsgAA+MUAAEieAACYigAA
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:
 The atomic arrangement of bastnasite-(Ce), Ce(CO3)F, and structural elements of
 synchysite-(Ce), rontgenite-(Ce), and parisite-(Ce)

qdat:
AAAAAAAAAAAAAAAAAgAAQEAAAAAIAEAAAAgCMAAAQABAAgRAABAggACIQABAIISEJAGAhQhIBAhQAhEAKEUAQjCWJBFIMCGUBgwDkosJyEXIaUHJEMMRoSjqFCM24IGiOBsBWaZYvCKmrMG2AWSdm2JsFYeKw0jxeE5NyR==


formula: Y2 C3 O11 H2
compound: <missing>
pub_title: The redefinition of tengerite-(Y), Y2(CO3)3.2-3H2O, and its crystal structure
formula_title: <missing>
a: 6.078
b: 9.157
c: 15.114
alpha: 90
beta: 90
gamma: 90
cell_volume: 841.188
crystal_density: 3.094
atoms_sites: ["Y", "C1", "C2", "O1", "O2", "O3", "O4", "O5", "O-H"]
atoms_x: gGseAACgDwCA2BAAgEMUAMCEBgBg+xIAoN4cAEBaCwBgKwsA
atoms_y: AAAAAKCvDwAA6AMAoN8HACBxDwBg4xYAgLsAAKDrBQDARBkA
atoms_z: WOMUANDxCwCAhB4AEG8NAHAyCABA/Q0AgIQeACCyGQDgFRkA
atoms_occupancy: 0
atoms_u_iso: ABJ6AJiKAAAAEnoAcJQAAFiiAABonAAAcOkAAAASegBAwwEA
atoms_aniso_label: ["Y", "C2", "O5"]
atoms_aniso_u11: AL4AALDMAABwOgAA
atoms_aniso_u22: QKEAABDHAAAo2gIA
atoms_aniso_u33: 6MYAAGAhAQAo1gEA
atoms_aniso_u12: WO7///DT//8AAAAA
atoms_aniso_u13: WLf//wAAAACYKwAA
atoms_aniso_u23: yEEAAAAAAAAI+f7/
qdat:
AAAAAAAAAAAAABAAAAAACBBBBACCAIBAAAEAgQIgJMgCQCMNABICCuiEFKCzwpkeAPKsi4pjLxrkDqpXWHSz2INc4rB/GnC/JPx0saAuuNZpi0yfIrdd8vUPVfngfr05pQtiSXdx8RvHfIuQ11aJnIKkCxdu7Fj/U2VDwf==


formula: (Na.8 K.2) Fe6.87 Mg1.83 Al.3 Si6 B3 O31 H3.12
compound: San Francisco mine, Villa Tunari, Bolivia
formula_title: <missing>
a: 16.186
b: 16.186
c: 7.444
alpha: 90
beta: 90
gamma: 120
cell_volume: 1688.947
crystal_density: 3.429
atoms_aniso_u11: MAsBADALAQDARAAAwEQAABBAAAAQQAAAEEAAAIBXAABguAAAUHgAAFB4AADQnQAAoL4AACCAAABgnwAAILIAAGCGAADQUgAA
atoms_aniso_u22: MAsBADALAQBAOAAAQDgAABBAAAAQQAAAEEAAADBDAADgRwAAUHgAAFB4AAAQQAAAUHgAAMDzAACAPgAA0GsAAEBqAACQlwAA
atoms_aniso_u33: QBMCAEATAgBguAAAYLgAADCOAAAwjgAAMI4AAJCXAADgeQAAUHgAAFB4AAAgywAAgIkAAODEAADwHQEAsIEAAPC5AABwEQEA
atoms_aniso_u12: mIUAAJiFAABgIgAAYCIAANAgAADQIAAA0CAAAMArAADwIwAAKDwAACg8AABAHwAAUF8AAOB5AACwTwAAEFkAAEAfAABQRgAA
atoms_aniso_u13: AAAAAAAAAADw8f//8PH//9AHAADQBwAA0AcAAGDw//+wBAAAAAAAAAAAAAAQDgAAYNf//2Cl///QBwAAwPn//+D8//9gOwAA
atoms_aniso_u23: AAAAAAAAAAAw+P//MPj//xAOAAAQDgAAEA4AAGDw//9gCQAAAAAAAAAAAAAgHAAAsOv//7DS//8gAwAAAOf///Dx///wVQAA
pub_title:
 Povondraite, a redefinition of the tourmaline ferridravite
 Note: Atomic parameters updated by Grice on 11/20/2001

atoms_sites:
["NaX", "KX", "FeY", "MgY", "FeZ", "MgZ", "AlZ", "SiT", "B", "O1", "O-H1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "H3"]

atoms_x:
AAAAAAAAAACAeAcAgHgHADA7EgAwOxIAMDsSAECMCwAQsgYAAAAAAAAAAAAguQMAILwPAMCjBQAgJQsAILsLADAoEQBgogwAMLcOAA==

atoms_y:
AAAAAAAAAABAvAMAQLwDALAIEACwCBAAsAgQAEBzCwAgZA0AAAAAAAAAAABAcgcAEN4HAIBHCwCQkgUA0CkLAFArEQDwWRAA0FoHAA==

atoms_z:
0OUNANDlDQBQPScAUD0nAMBgJQDAYCUAwGAlAAAAAADg0RsAYBsvAGAbLwAQ8B0AsEQfAEA5BAAgSQUA4NYvACCaBABA+hoAMJQYAA==

atoms_occupancy:
ANQwAAA1DABA4TMAwCcJAADyKwDACQ4AQA0DAAAJPQAACT0AALY1AABTBwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
YGcBAGBnAQCQZQAAkGUAAKBaAACgWgAAoFoAAMBdAABwlAAAYG0AAGBtAABAnAAAoIwAAOCrAABAnAAAAH0AAECcAABAnAAAgDgBAA==

atoms_aniso_label:
["NaX", "KX", "FeY", "MgY", "FeZ", "MgZ", "AlZ", "SiT", "B", "O1", "O-H1", "O2", "O3", "O4", "O5", "O6", "O7", "O8"]

qdat:
AAAAAAAAAAAAAgAAgAAAEAIAIBAAAQIBAgYEAABhAgwhRADFEEQhAEYCNIQKhMJiDojNGCmg7gCon2jbLiQmpagrKYH4vcJ12iRj0Vq2FtdGuik1TGPXFcuKgMDDaL7IlcjQUS3qykMllLw7KWSDGyaAPaEiAOCRBIQMgg==


formula: K (Si2 Al) O6
compound: <missing>
formula_title: <missing>
a: 12.988
b: 12.988
c: 13.800
alpha: 90
beta: 90
gamma: 90
cell_volume: 2327.896
crystal_density: 2.491
atoms_sites: ["K", "Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: wFYWALBvAwCwbwMAQC4KAEAuCgAQ+xcAEPsXAHAZCACQYAUAsOcIAFAWCADgqREA8IgdAA==
atoms_y: cCkWALA8GACwPBgAsFIlALBSJQDwGicA8BonAKBMEwBwVx8AsJ4pABDaKQDQ/SIAkJolAA==
atoms_z: kIwGAPAyCgDwMgoA0L4HANC+BwAALQUAAC0FABCyBgCQHAgAkMYNAPAwAgBwOAcAMCAKAA==
atoms_occupancy: AAk9ALiwKABIWBQAuLAoAEhYFAC4sCgASFgUAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==
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
pub_title:
 On the role of Al-Si ordering in the cubic-tetragonal phase transition of
 leucite
 Sample is Disordered

qdat:
AAAAAAAAAAAgAAAAQAAkAABAQIAAAioAIQYAhEhAIggBoiIxIqEgQCjIYya4HIj0lGmgnIioc0XJlGqdi5as8i52it0dpyq0RrDGBgzKTMgCKETBUQhAAAiRBAAAAAACQQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: K Si2 Al O6
compound: <missing>
formula_title: <missing>
a: 12.931
b: 12.931
c: 13.812
alpha: 90
beta: 90
gamma: 90
cell_volume: 2309.515
crystal_density: 2.511
atoms_sites: ["K", "Si1", "Al", "Si2", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: kKkWAMBkAwAgXQoAoEcYAADpBwCwSgUA0LgIALDtBwAgRhIAsOYdAA==
atoms_y: AMcVAIArGAAgOCUAENMmACBAEwBA+x4AENopAEDrKQBAyiIA8KMlAA==
atoms_z: EOQGAJBCCgCwuwcAwCYFABCyBgAAGwgAEOwNAAD0AQBwOAcAQPwJAA==
atoms_occupancy: 0
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
pub_title:
 On the role of Al-Si ordering in the cubic-tetragonal phase transition of
 leucite
 Sample is Order model 1

qdat:
AAAAAAAAAAAQAAAAQAAiAABAQEAAAhYAIIYAQkhAIQgAohFRCTEQYCJkS5JUGkTWRHTQSSWMNZR0rCtKwlW6VKMUqpVCasklETQRQUMiSlQAiRIoSIEIAAEkQQAAAAAAkCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: K (Si2 Al) O6
compound: <missing>
formula_title: <missing>
a: 13.005
b: 13.005
c: 13.765
alpha: 90
beta: 90
gamma: 90
cell_volume: 2328.075
crystal_density: 2.491
atoms_sites: ["K", "Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: IBUWAEBxAwBAcQMA8DIKAPAyCgBg9hcAYPYXAIBACABggQUAcPoIAIBACAAgsBEAYIcdAA==
atoms_y: sBYWAOBNGADgTRgAYHAlAGBwJQBQJCcAUCQnAABWEwDwfB8AAJopAPAIKgDgJCMAcLAlAA==
atoms_z: UE4HAIA0CgCANAoAsNQHALDUBwBQQQUAUEEFAFDRBgAgHggAwPANAEBeAgAQYQcAcCYKAA==
atoms_occupancy: AAk9AICEHgCAhB4AwMYtAEBCDwDAxi0AQEIPAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==
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
pub_title:
 On the role of Al-Si ordering in the cubic-tetragonal phase transition of
 leucite
 Sample is Order model 2

qdat:
AAAAAAAAAAAgAAAAQAAkAABAQIAAAikAQQkAhIhAIgQBokIxIsFAYBlIZym4DIh4ksqgrxDQvkfJ8nSeUxUo8im0ip4tpjKkhqGGBg9UTIgFKGTBURBAABCTCAAAAAACQQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: K (Si3 Al) O8
compound: <missing>
pub_title: High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 0.00 GPa
formula_title: KAlSi3O8
a: 9.315
b: 9.315
c: 2.723
alpha: 90
beta: 90
gamma: 90
cell_volume: 236.273
crystal_density: 3.912
atoms_sites: ["K", "Si", "Al", "O1", "O2"]
atoms_x: AAAAAFBeFQBQXhUAYFAJAOD+IAA=
atoms_y: AAAAAFAjCgBQIwoAQG0MAAAPCgA=
atoms_z: gIQeAAAAAAAAAAAAAAAAAAAAAAA=
atoms_occupancy: AAk9AMDGLQBAQg8AAAk9AAAJPQA=
atoms_u_iso: cOkAANhoAADYaAAAELgAADikAAA=
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:
AAAAAAAAAAAAAAABAAAAAAEAAAAAAAABAAAEAAAAgAAAAggCAAIQAAABAIAAQAACAEAEQAASAAAABAEEQiAQDCAEAREBCAAJCAEBEhIEBACAIAGKFACRgQYIUQMEIECWYAIUAAQIwBgiBIEUggCACEQAgFCkRgghIlEIUA==


formula: K (Si3 Al) O8
compound: <missing>
pub_title: High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 1.64 GPa
formula_title: KAlSi3O8
a: 9.285
b: 9.285
c: 2.717
alpha: 90
beta: 90
gamma: 90
cell_volume: 234.236
crystal_density: 3.946
atoms_sites: ["K", "Si", "Al", "O1", "O2"]
atoms_x: AAAAAFBeFQBQXhUAwFkJALAGIQA=
atoms_y: AAAAAKAeCgCgHgoAQG0MADAgCgA=
atoms_z: gIQeAAAAAAAAAAAAAAAAAAAAAAA=
atoms_occupancy: AAk9AMDGLQBAQg8AAAk9AAAJPQA=
atoms_u_iso: kN0AAChVAAAoVQAAeJYAANhyAAA=
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:
AAAAAAAAAAAAAAAAgAAAAAEAAAAAAAABAAACAAAAQAAAAQgBAAEIAAAAgEAAIAABABACIAAIgAAAAgCBIJAIBhABAITAQgACQgBAhISBAgAgCABihQAkQEKCFEDBCBAimACFAAECKAYIgRAlIIAQAREAEBQlEUQEKExCEg==


formula: K (Si3 Al) O8
compound: <missing>
pub_title: High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 2.95 GPa
formula_title: KAlSi3O8
a: 9.261
b: 9.261
c: 2.712
alpha: 90
beta: 90
gamma: 90
cell_volume: 232.598
crystal_density: 3.974
atoms_sites: ["K", "Si", "Al", "O1", "O2"]
atoms_x: AAAAAHBhFQBwYRUAYGkJAID1IAA=
atoms_y: AAAAADAgCgAwIAoAsGsMALATCgA=
atoms_z: gIQeAAAAAAAAAAAAAAAAAAAAAAA=
atoms_occupancy: AAk9AMDGLQBAQg8AAAk9AAAJPQA=
atoms_u_iso: 6MEAAAhXAAAIVwAAWKIAAMh4AAA=
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:
AAAAAAAAAAAAAAAAgAAAAACAAAAAAAAAgAACAAAAQAAAAQQAgAEIAAAAQCAAEAAAgAgBEAAEQAAAAQBAkEgCAQQAQEFgIQAAsIAgIUJAgIAIBAARIUAKIBEgiRBQRAQIpABBQABAigJCIEgJJCAIAEJABAUJRGCBCiUIhI==


formula: K (Si3 Al) O8
compound: <missing>
pub_title: High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 3.60 GPa
formula_title: KAlSi3O8
a: 9.247
b: 9.247
c: 2.710
alpha: 90
beta: 90
gamma: 90
cell_volume: 231.724
crystal_density: 3.989
atoms_sites: ["K", "Si", "Al", "O1", "O2"]
atoms_x: AAAAALBnFQCwZxUAoG8JABD3IAA=
atoms_y: AAAAAOAkCgDgJAoA4GMMALATCgA=
atoms_z: gIQeAAAAAAAAAAAAAAAAAAAAAAA=
atoms_occupancy: AAk9AMDGLQBAQg8AAAk9AAAJPQA=
atoms_u_iso: CMAAABhRAAAYUQAAMKwAAMB2AAA=
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:
AAAAAAAAAAAAAAAAgAAAAACAAAAAAAAAgAABAAAAIAAAAIQAgACEAAAAQCAACAAAgAgAkAACQAAAAIBgkCQCAQIAQECgIIAAUIAQIKEgQIAEAgAIUSAFGAigRQhIIgEIcwAgYABASQEhEBIEYhAEACEgAgMIwTCARhGEIi==


formula: K (Si3 Al) O8
compound: <missing>
pub_title: High-pressure crystal chemistry of KAlSi3O8 hollandite Pressure = 4.47 GPa
formula_title: KAlSi3O8
a: 9.237
b: 9.237
c: 2.706
alpha: 90
beta: 90
gamma: 90
cell_volume: 230.882
crystal_density: 4.004
atoms_sites: ["K", "Si", "Al", "O1", "O2"]
atoms_x: AAAAAHBhFQBwYRUA0GcJAOD+IAA=
atoms_y: AAAAAOAkCgDgJAoAMF8MAPDnCQA=
atoms_z: gIQeAAAAAAAAAAAAAAAAAAAAAAA=
atoms_occupancy: AAk9AMDGLQBAQg8AAAk9AAAJPQA=
atoms_u_iso: +LsAANhoAADYaAAAcJQAAKiEAAA=
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:
AAAAAAAAAAAAAAAAgAAAAACAAAAAAAAAgAABAAAAIAAAAIIAQACEAAAAIBAACAAAQAQAiAACIAAAAIAwSBIBAIIAICCQEEAASEAIEFCgIEAEAQAEUKACiARQIoQUEQEEMQAQUAAgIwBQSAkCMQgBABCQAIFCUJhAIoTBER==


formula: Si3 Al2 Mg3 O12
compound: <missing>
formula_title: <missing>
a: 11.4566
b: 11.4566
c: 11.4566
alpha: 90
beta: 90
gamma: 90
cell_volume: 1503.721
crystal_density: 3.561
atoms_sites: ["Si", "Al", "Mg", "O"]
atoms_x: YOMWAAAAAAAgoQcAEAICAA==
atoms_y: AAAAAAAAAAAAAAAA0A4DAA==
atoms_z: QEIPAAAAAABAQg8AANgnAA==
atoms_occupancy: 0
atoms_u_iso: +DkAAKBGAADYiwAAWDkAAA==
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:
 Syntheses, volume, and structural changes of garnets in the pyrope-grossular
 join: Implications for stability and mixing properties
 Sample JW12

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABABACAAAgCAAAAIBAQAAgICAgQEAAAgQIIEECACBABBCCACEEIIQgBACEIQgCIABEIQiIAiIBAAhEQEACIAAiICIAQAAIAAACAAAAAAAABEAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 (Mg2.412 Ca.588) O12
compound: <missing>
formula_title: <missing>
a: 11.4520
b: 11.4520
c: 11.4520
alpha: 90
beta: 90
gamma: 90
cell_volume: 1501.910
crystal_density: 3.648
atoms_sites: ["Si", "Al", "Mg", "Ca", "O"]
atoms_x: YOMWAAAAAAAgoQcAIKEHAHALAgA=
atoms_y: AAAAAAAAAAAAAAAAAAAAAKD9AgA=
atoms_z: QEIPAAAAAABAQg8AQEIPAHDWJwA=
atoms_occupancy: AAk9AAAJPQCAEjEAgPYLAAAJPQA=
atoms_u_iso: aD0AALgaAADQawAA0GsAAIAqAAA=
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:
 Syntheses, volume, and structural changes of garnets in the pyrope-grossular
 join: Implications for stability and mixing properties
 Sample JW13

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQACAAABABABACAAAQCAAAAIBAIAAgICAgQEAAAgQIIECCACBABBBCACEEEIQQBACEIQgCEABCEQiEAhEBAAREQCACIAAiICIAQAAIAAACAAAAAAAAAkAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 (Mg2.226 Ca.774) O12
compound: <missing>
formula_title: <missing>
a: 11.5670
b: 11.5670
c: 11.5670
alpha: 90
beta: 90
gamma: 90
cell_volume: 1547.613
crystal_density: 3.565
atoms_sites: ["Si", "Al", "Mg", "Ca", "O"]
atoms_x: YOMWAAAAAAAgoQcAIKEHAEATAgA=
atoms_y: AAAAAAAAAAAAAAAAAAAAAJDvAgA=
atoms_z: QEIPAAAAAABAQg8AQEIPAFDTJwA=
atoms_occupancy: AAk9AAAJPQDASS0AQL8PAAAJPQA=
atoms_u_iso: IE4AALhCAACIcgAAiHIAAOhOAAA=
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:
 Syntheses, volume, and structural changes of garnets in the pyrope-grossular
 join: Implications for stability and mixing properties
 Sample JW28

qdat:
AAAAAAAAAAAAAAAAAAAAAAQAACAAAAAAABAAQAAAEAEAIAQAAEAQAAABAICAAICAgIEBAAAIIECCBBAAggAghBABCCEIIQAgCEIQgCIABCIRCIBCIBAAiIgIAEQABEQIgAgAAgAAAQAAAAAAAAEQAAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 Mg.888 Ca2.106 O12
compound: <missing>
formula_title: <missing>
a: 11.7445
b: 11.7445
c: 11.7445
alpha: 90
beta: 90
gamma: 90
cell_volume: 1619.958
crystal_density: 3.577
atoms_sites: ["Si", "Al", "Mg", "Ca", "O"]
atoms_x: YOMWAAAAAAAgoQcAIKEHAPAwAgA=
atoms_y: AAAAAAAAAAAAAAAAAAAAAHDTAgA=
atoms_z: QEIPAAAAAABAQg8AQEIPAGDIJwA=
atoms_occupancy: AAk9AAAJPQAAERIAwNgqAAAJPQA=
atoms_u_iso: 6D8AAMA6AABAYAAAQGAAANAqAAA=
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:
 Syntheses, volume, and structural changes of garnets in the pyrope-grossular
 join: Implications for stability and mixing properties
 Sample JW22

qdat:
AAAAAAAAAAAAAAAAAAAAABAAAQAAAAAAAIACAAABABACAEAABAEAAAAgIBAAEBAgIECAAAQIEECCCABBACCCEAEIIQghAEAQhCEAhAAQhEQiAQiAQAREICACIABEQEQAgAAgAAAIAAAAAAAAIgAAAAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 (Mg.609 Ca2.391) O12
compound: <missing>
formula_title: <missing>
a: 11.7817
b: 11.7817
c: 11.7817
alpha: 90
beta: 90
gamma: 90
cell_volume: 1635.400
crystal_density: 3.581
atoms_sites: ["Si", "Al", "Mg", "Ca", "O"]
atoms_x: YOMWAAAAAAAgoQcAIKEHAHA9AgA=
atoms_y: AAAAAAAAAAAAAAAAAAAAAMDOAgA=
atoms_z: QEIPAAAAAABAQg8AQEIPACDCJwA=
atoms_occupancy: AAk9AAAJPQDgYwwAIKUwAAAJPQA=
atoms_u_iso: yEsAALA2AADAUwAAwFMAAHAwAAA=
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:
 Syntheses, volume, and structural changes of garnets in the pyrope-grossular
 join: Implications for stability and mixing properties
 Sample JW3

qdat:
AAAAAAAAAAAAAAAAAAAAABAAAQAAAAAAAIAEAAACACAEAIAACAIAAABAQCAAICBAQIEAAAgQQIIIEAAEAEEIIAQQhBCEAQAiEIQCCABCEQiEBEICABERAIAIgAERAiACAACAAABAAAAAAAABIAAAAAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 (Mg.453 Ca2.547) O12
compound: <missing>
formula_title: <missing>
a: 11.8063
b: 11.8063
c: 11.8063
alpha: 90
beta: 90
gamma: 90
cell_volume: 1645.665
crystal_density: 3.578
atoms_sites: ["Si", "Al", "Mg", "Ca", "O"]
atoms_x: YOMWAAAAAAAgoQcAIKEHAAA/AgA=
atoms_y: AAAAAAAAAAAAAAAAAAAAAGDFAgA=
atoms_z: QEIPAAAAAABAQg8AQEIPALDDJwA=
atoms_occupancy: AAk9AAAJPQBgNwkAoNEzAAAJPQA=
atoms_u_iso: IEQAAOgrAABIRAAASEQAANAlAAA=
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:
 Syntheses, volume, and structural changes of garnets in the pyrope-grossular
 join: Implications for stability and mixing properties
 Sample JW15

qdat:
AAAAAAAAAAAAAAAAAAAAACAAAgAAAAAAAQAEAAACACAEAQAAEAQAAACAQEAAQECAgQIAABAggQQIIAIIAIQQQAhBCEEIAgCEIQgEIACEQiEQCIQEACIiAgAiAAJEBEAIAAIAAAEAAAAAAAACQAAAAAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 Ca3 O12
compound: <missing>
formula_title: <missing>
a: 11.8515
b: 11.8515
c: 11.8515
alpha: 90
beta: 90
gamma: 90
cell_volume: 1664.638
crystal_density: 3.595
atoms_sites: ["Si", "Al", "Ca", "O"]
atoms_x: YOMWAAAAAAAgoQcAgEsCAA==
atoms_y: AAAAAAAAAAAAAAAAYMUCAA==
atoms_z: QEIPAAAAAABAQg8AkMAnAA==
atoms_occupancy: 0
atoms_u_iso: gDQAABguAADoPwAAWCUAAA==
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:
 Syntheses, volume, and structural changes of garnets in the pyrope-grossular
 join: Implications for stability and mixing properties
 Sample JW11

qdat:
AAAAAAAAAAAAAAAAAAAAACAAAgAAAAAAAgAIAAAEAEAIAgAAIAgAAAEBAIAAgQECAgQAACCBBAgggAggAghBACCEIIQgCAIQhCAQgAIhEIhAQiAgAREQEAEQABEgIgBAABAAAAgAAAAAAAAiAAAAAAAAAAAAAAAAAAAAAA==


formula: K2.28 (Mg1.14 Si2.86) O8
compound: <missing>
formula_title: BCTT
a: 8.957
b: 8.957
c: 5.281
alpha: 90
beta: 90
gamma: 90
cell_volume: 423.683
crystal_density: 2.549
atoms_sites: ["K1", "K2", "Mg", "Si", "O1", "O2"]
atoms_x: AAAAAAAAAABQBAsAUAQLAAAWDQAQohEA
atoms_y: gIQeAAAAAABQBAsAUAQLAAAAAAAQohEA
atoms_z: ABESALBjHgAAAAAAAAAAAPA9BACgrgsA
atoms_occupancy: ABAnAAAJPQAgZREA4KMrAAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["K1", "K2", "Mg", "Si", "O1", "O2"]
atoms_aniso_u11: GH0BAJi6AgAg/AEAIPwBALCyBgCoMwYA
atoms_aniso_u22: iDcEAJi6AgAg/AEAIPwBAJi6AgCoMwYA
atoms_aniso_u33: KHUcAND7AQCYzwEAmM8BAPh7BADwXAMA
atoms_aniso_u12: AAAAAAAAAACQwP//kMD//wAAAABYR/z/
atoms_aniso_u13: AAAAAAAAAADYSgAA2EoAAAhRAQAIUQEA
atoms_aniso_u23: AAAAAAAAAADYSgAA2EoAAAAAAAAIUQEA
pub_title:
 Crystal structures of the body-centered tetragonal tectosilicates:
 K1.14Mg0.57Si1.43O4, K1.10Zn0.55Si1.45O4, and K1.11Fe1.11Si0.89O4
 Sample: Mg-rich phase

qdat:
AAAAAAAAAAAAAAAAEAAAAAAoAAAAAAAABgAAAgACIAAgAAlAACACYAQAAAACCKAEAiwAQgQCBBgAEUBICgCI4AiMAgACiUAiMEERCVEJURBSUkQlgQERJlA4ZQqWTLFhlCiS4oBBpRQqZIwSUhFANCCIlRsigKG8KQTAgI==


formula: K2.2 (Zn1.1 Si2.9) O8
compound: <missing>
formula_title: BCTT
a: 8.939
b: 8.939
c: 5.246
alpha: 90
beta: 90
gamma: 90
cell_volume: 419.185
crystal_density: 2.911
atoms_sites: ["K1", "K2", "Zn", "Si", "O1", "O2"]
atoms_x: AAAAAAAAAACgGAsAoBgLAGBRDQCAhxEA
atoms_y: gIQeAAAAAACgGAsAoBgLAAAAAACAhxEA
atoms_z: gMYTAKBVHgAAAAAAAAAAAMBLAwAANQwA
atoms_occupancy: AJ8kAAAJPQDgyBAAIEAsAAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["K1", "K2", "Zn", "Si", "O1", "O2"]
atoms_aniso_u11: wMP+/3h1AwDw+QEA8PkBAHh1AwC4sQQA
atoms_aniso_u22: mHIEAHh1AwDw+QEA8PkBADA2AwC4sQQA
atoms_aniso_u33: MIEwACBMAgA43wEAON8BAKglDwBQBQUA
atoms_aniso_u12: AAAAAAAAAAC4wP//uMD//wAAAADAw/7/
atoms_aniso_u13: AAAAAAAAAADYAwEA2AMBAOAsAgDwsf7/
atoms_aniso_u23: AAAAAAAAAADYAwEA2AMBAAAAAADwsf7/
pub_title:
 Crystal structures of the body-centered tetragonal tectosilicates:
 K1.14Mg0.57Si1.43O4, K1.10Zn0.55Si1.45O4, and K1.11Fe1.11Si0.89O4
 Sample: Zn-rich phase

qdat:
AAAAAAAAAAAAAAAAEAAAAAAUAAAAAAAAAwAAAgABEAAQAALAACABIAEAAAACAlACAJYAIEIBAIwAAqARBkBRcAEkgQAAkWgEmCBKFFgRVhoYIpBRYIAhyQQPDQiVJKwkMSiKeDAITJYkRJcC6UihA4gEiJKyFBTSsMgaiC==


formula: K2.22 (Fe2.22 Si1.78) O8
compound: <missing>
formula_title: BCTT
a: 9.102
b: 9.102
c: 5.341
alpha: 90
beta: 90
gamma: 90
cell_volume: 442.483
crystal_density: 2.918
atoms_sites: ["K1", "K2", "Fe", "Si", "O1", "O2"]
atoms_x: AAAAAAAAAACgGAsAoBgLAECADQCg7hEA
atoms_y: gIQeAAAAAACgGAsAoBgLAAAAAACg7hEA
atoms_z: gEkTAABGHgAAAAAAAAAAAGDSBACA/AoA
atoms_occupancy: QDslAAAJPQDg3yEAICkbAAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["K1", "K2", "Fe", "Si", "O1", "O2"]
atoms_aniso_u11: WAYBAFgGAQBwiQEAcIkBAPDdBAAQywEA
atoms_aniso_u22: oEEAAFgGAQBwiQEAcIkBAPhHAQAQywEA
atoms_aniso_u33: wFYqABg8AQA42gEAONoBALAdBQAweAIA
atoms_aniso_u12: AAAAAAAAAABgvv//YL7//wAAAABgvv//
atoms_aniso_u13: AAAAAAAAAACoP///qD///1jAAAAQGf//
atoms_aniso_u23: AAAAAAAAAACoP///qD///wAAAAAQGf//
pub_title:
 Crystal structures of the body-centered tetragonal tectosilicates:
 K1.14Mg0.57Si1.43O4, K1.10Zn0.55Si1.45O4, and K1.11Fe1.11Si0.89O4
 Sample: Fe-rich phase

qdat:
AAAAAAAAAAAAAAAAIAAAAACgAAAAAAAAMAAAIAASAAEAAFgABAAsAEAAAACAlACASgAgQgEAjAACwCEKgKLgBIkCAAIpoBJAgjCioJKxUYElAxYIAjUggOGhFOiXDQpKIp4UAicqkjJVgdkooQWIBJEU1BgmxWGQJiBJsS==


formula: Si8 Mg5 (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.0547
b: 17.997
c: 5.2746
alpha: 90
beta: 104.832
gamma: 90
cell_volume: 922.660
crystal_density: 3.003
atoms_sites: ["Si1", "Si2", "Mg1", "Mg2", "Mg3", "Na", "Ca", "K", "O1", "O2", "O-H3", "O4", "O5", "O6", "O7"]
atoms_x: ENoQADBaEQAAAAAAAAAAAAAAAAAAAAAAAAAAANBMAQDwlQYAAO8GAGCUBgBgnhUAkGoUAPC+FADw9hMA
atoms_y: MD4FAOBvCgBwdgUAYPkKAAAAAAAQ2hAAENoQAICEHgAAXwUAQHkKAAAAAABgLA8AQO8HAPASBwAAAAAA
atoms_z: 0GMSAID5MACAhB4AAAAAAAAAAACAhB4AgIQeAGCyAQDQHQ0AgMwrAEAqLADg7y8AkMQFAODNJAAAwBIA
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQCAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KNi0
 Atomic parameters from ICSD

qdat:
AAAAAAAAAAACQAAAAAAAEEAKEAQAAAAiBIAoCACAGgTUCEkQogBsoHQESYbAC3jEDPCmDgrUKEkbJaUCDtQqNr7o0IZJl8LBe40hqUiouewbcpdBTsGNPszSpSsZCp3irHNqFVq4LTIgC8daJ0CjgmlfkUj6whoQ6ixJqR==


formula: Si8 (Mg3.86 Ni1.14) (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.0536
b: 17.982
c: 5.2702
alpha: 90
beta: 104.879
gamma: 90
cell_volume: 920.821
crystal_density: 3.151
atoms_x: ENoQAMBbEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAPAdAQBQuAYAoP4GADCDBgBAzRUAENsUAJCcFACQHxQA
atoms_y: kC4FALB3CgDQfwUA0H8FAODsCgDg7AoAAAAAAAAAAAAw3RAAMN0QAICEHgCAawUAcIoKAAAAAABgRQ8AQAgIACAkBwAAAAAA
atoms_z: YH4SACAJMQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAKBOAgCgJQ0AYC0sAPBNKwAQnS8A8M0FALCKJADw4xIA
atoms_occupancy: AAk9AAAJPQAA8isAABcRAIDuNgCAGgYAgNclAIAxFwCAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KNi20
 Atomic parameters from ICSD

atoms_sites:
["Si1", "Si2", "Mg1", "Ni1", "Mg2", "Ni2", "Mg3", "Ni3", "Na", "Ca", "K", "O1", "O2", "O-H3", "O4", "O5", "O6", "O7"]

qdat:
AAAAAAAAAAACQAAAAAAAEEAKEAQAAAAiBIAoBACAGwC0CEkIYgBcoGwESIZgBrTEDOhVDQrMGGUbJuMCDUwrL35kSIVpl6Nh+40Q5MxU/aQe6U+hJaFPq+aqkzsdDd7jbDGlCq1cGxqQBKGtI7BRoTTPqJQ1YYkIeyRE1I==


formula: Si8 (Mg2.75 Ni2.25) (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.0492
b: 17.975
c: 5.2661
alpha: 90
beta: 104.904
gamma: 90
cell_volume: 919.237
crystal_density: 3.294
atoms_x: 0NMQAPBTEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAANDoAAAgjgYA8BIHAFCGBgAAxxUAwN8UANDUFADwDxQA
atoms_y: gDkFACBdCgCwfAUAsHwFAODsCgDg7AoAAAAAAAAAAADgyBAA4MgQAICEHgCAawUAkHQKAAAAAAAwGw8AgPUHAAAIBwAAAAAA
atoms_z: cHMSAGAPMQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAHDZAQAgtQwAEBksACAnLABAdjAAQEYGALCjJADwTRIA
atoms_occupancy: AAk9AAAJPQCAExwAgPUgAECOLADAehAAQJUWAMBzJgCAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KNi40
 Atomic parameters from ICSD

atoms_sites:
["Si1", "Si2", "Mg1", "Ni1", "Mg2", "Ni2", "Mg3", "Ni3", "Na", "Ca", "K", "O1", "O2", "O-H3", "O4", "O5", "O6", "O7"]

qdat:
AAAAAAAAAAACIAAAAAAAEEAKEAQAAAAxBEAoBABAFwR0CEiIYgA6sGwESIJgBrzkDLhXCwVsFGSWktOBC0oZn1p0aMNozWKgt0qQ9KZ0XOYPuUegp6FHn2dZkp2Mhu5xtiiziqTOHZ1IBOHWk9hpUSpnnJI60EyEP5Ii0k==


formula: Si8 (Mg1.78 Ni3.22) (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.0436
b: 17.962
c: 5.2633
alpha: 90
beta: 104.936
gamma: 90
cell_volume: 917.436
crystal_density: 3.421
atoms_x: MMQQANBpEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAATAQCAsAYAAAgHADCDBgBAtBUAIOkUAEC6FAAgUxQA
atoms_y: 8DcFALBeCgBwdgUAcHYFAMDpCgDA6QoAAAAAAAAAAADAxRAAwMUQAICEHgDQZgUAUIcKAAAAAADwFA8AsO0HAPASBwAAAAAA
atoms_z: gJoSAAAfMQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAMBqAgAALw0AwB0sAPDjKwBAKzAAMFEGAFCaJACA/hIA
atoms_occupancy: AAk9AAAJPQBAQg8AwMYtAID1IACAExwAADUMAADUMACAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KNi60
 Atomic parameters from ICSD

atoms_sites:
["Si1", "Si2", "Mg1", "Ni1", "Mg2", "Ni2", "Mg3", "Ni3", "Na", "Ca", "K", "O1", "O2", "O-H3", "O4", "O5", "O6", "O7"]

qdat:
AAAAAAAAAAACIAAAAAAAGEAKEAIAAAAxBEAoBABADQR0CEiIcgA6sHoESIJgBbxkDHg3BoVuFFSNkvLBB2YVlz80aEK06+GgXcWIrmYqdvUO+KfQkpClz/M0yVqGwmV47xxZhVZvC17EAvDSScg4sJZXzkkeaEbCH8kQ+S==


formula: Si8 (Mg.93 Ni4.07) (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.0382
b: 17.954
c: 5.2610
alpha: 90
beta: 104.954
gamma: 90
cell_volume: 916.057
crystal_density: 3.532
atoms_x: sJ4QAPCFEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAALBiAQAgdQYAADoHANBgBgBg6RUAoPUUAEC6FACgRhQA
atoms_y: sDEFABBoCgCwfAUAsHwFABDlCgAQ5QoAAAAAAAAAAADgrxAA4K8QAICEHgAgYgUAcHEKAAAAAAAQ/w4A4P4HACALBwAAAAAA
atoms_z: YGUSALA8MQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeACB0AgCwAQ0A4J0sAOCjKwBwVTAAoGgGADCwJABglxIA
atoms_occupancy: AAk9AAAJPQCAGgYAgO42AEAkFADA5CgAwEUEAEDDOACAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KNi80
 Atomic parameters from ICSD

qdat:
AAAAAAAAAAACIAAAAAAAGCAKEAIAAAAxBEAkBABADQRyCESIUQA2UHoCKMIgBbxkBngqhoVmDDKNU3HBBuUVl68yJEG057GwW6VIa1I6dvMGvGWwU9Bz7rMsxU6HQ3co2wx5wrZdiUqkAnjyKOQccEsv7iUXZGNhFuWItR==


formula: Si8 Ni5 (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.0297
b: 17.942
c: 5.2576
alpha: 90
beta: 104.982
gamma: 90
cell_volume: 913.959
crystal_density: 3.657
atoms_sites: ["Si1", "Si2", "Ni1", "Ni2", "Ni3", "Na", "Ca", "K", "O1", "O2", "O-H3", "O4", "O5", "O6", "O7"]
atoms_x: gL8QAJBjEQAAAAAAAAAAAAAAAAAAAAAAAAAAAPBoAQCgaAYAkCIHAHCJBgAQ7hUA4C0VAHCZFACAXBQA
atoms_y: QDMFAMBsCgBwdgUAgOMKAAAAAABAuRAAQLkQAICEHgAQbQUAkFsKAAAAAADw+w4A0CIIAAAhBwAAAAAA
atoms_z: sHkSAPApMQCAhB4AAAAAAAAAAACAhB4AgIQeAMBRAgDA9gwAkLssAMCHKwBw8S8A0KsGABCUJACQJRMA
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQCAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KNi100
 Atomic parameters from ICSD

qdat:
AAAAAAAAAAACIAAAAAAAGCAKEAIAAAAxAkAkBABADQJSBCSIUQAuUDYCIEMgA35yBlQrgoU2CjJLSWlBA6UKy6+aNEFaZejQfuVIO1MVP2kHvFPoSWhR5+maZK1DIbO8dYoswqtNhZdiATh5JHQKOCab3xKKtBGxB3RIVp==


formula: Si8 (Mg3.99 Co1.01) (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.0711
b: 18.015
c: 5.2760
alpha: 90
beta: 104.836
gamma: 90
cell_volume: 925.318
crystal_density: 3.120
atoms_x: MMQQALBmEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAWAQAwnAYAADoHAHCiBgBg0BUAsLgUAOCwFADAMBQA
atoms_y: 8DcFAOBvCgBggQUAYIEFAID8CgCA/AoAAAAAAAAAAADQ0xAA0NMQAICEHgDwaQUAEIEKAAAAAADQKg8AwPsHAKAXBwAAAAAA
atoms_z: QGISAGD2MACAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAJD1AQCgDA0AkCUsAGCwKwBAEjAA0OMFALBYJACw3RIA
atoms_occupancy: AAk9AAAJPQAAYy4AAKYOAIB9NACAiwgAwMYtAEBCDwCAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KCo20
 Atomic parameters from ICSD

atoms_sites:
["Si1", "Si2", "Mg1", "Co1", "Mg2", "Co2", "Mg3", "Co3", "Na", "Ca", "K", "O1", "O2", "O-H3", "O4", "O5", "O6", "O7"]

qdat:
AAAAAAAAAAACQAAAAAAAEEAKEAQAAABiBIBICACAGgTkEJEQ5AB04HQIkQTADXnIGXCuCg1YKMo1RccEG5QyXLzJoYbTr0aBbxZC6ZipetQ94x+CXUMffY1mSnYzE7lG2KLuGrVoSnYgE4eSTkClhLK+tlDzRDwRbkiLqR==


formula: Si8 (Mg3.02 Co1.98) (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.0817
b: 18.021
c: 5.2753
alpha: 90
beta: 104.832
gamma: 90
cell_volume: 926.494
crystal_density: 3.237
atoms_x: MN0QAOBeEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAFAnAQBgrQYAoDAHALB2BgBg0BUAAOYUAAC0FABgJxQA
atoms_y: gDkFADBrCgAwiQUAMIkFAADwCgAA8AoAAAAAAAAAAABg1RAAYNUQAICEHgBAZQUA4KEKAAAAAACwDg8AsAYIABAvBwAAAAAA
atoms_z: UIkSAIASMQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAPAXAgDglQwAgBcsACBfKwDAui8AAEAGACBXJAAAwBIA
atoms_occupancy: AAk9AAAJPQDAkSEAQHcbAMBVKwBAsxEAgIQeAICEHgCAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KCo40
 Atomic parameters from ICSD

atoms_sites:
["Si1", "Si2", "Mg1", "Co1", "Mg2", "Co2", "Mg3", "Co3", "Na", "Ca", "K", "O1", "O2", "O-H3", "O4", "O5", "O6", "O7"]

qdat:
AAAAAAAAAAACQAAAAAAAEEASEAQAAABiCIBICACAGgjoEJEQ5AB1YNgIkQTADnmIGVCuGhVYMMo2TcsEG5QiXPzJoorTL4qDzSxC6pjJrpRdkx6CXkUuvp1uSrRVEqmK+SO2HTVoXLZgE4+yNsGniLK8tpCzRDwhqlESqh==


formula: Si8 (Mg2.08 Co2.92) (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.0923
b: 18.032
c: 5.2742
alpha: 90
beta: 104.829
gamma: 90
cell_volume: 927.854
crystal_density: 3.348
atoms_x: YCARAGA5EQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACDkAACg5QYAkNcGACBDBgBQqRUAQOwUANDUFABg9RMA
atoms_y: sEoFACB2CgBwdgUAcHYFAND3CgDQ9woAAAAAAAAAAADArBAAwKwQAICEHgBQjAUA8JYKAAAAAABgEw8AkAMIAOAdBwAAAAAA
atoms_z: kHYSAIASMQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAMB9AwAQwAwAQHsrAJCPKwAAqC8A4CMGALAgJQCgthIA
atoms_occupancy: AAk9AAAJPQCAMRcAgNclAICEHgCAhB4AAIgTAACBKQCAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KCo60
 Atomic parameters from ICSD

atoms_sites:
["Si1", "Si2", "Mg1", "Co1", "Mg2", "Co2", "Mg3", "Co3", "Na", "Ca", "K", "O1", "O2", "O-H3", "O4", "O5", "O6", "O7"]

qdat:
AAAAAAAAAAACQAAAAAAAEEASIAQAAABiCIBICACAGgDoEJEQ5AB5YNgIowyADrmQMVCsGhVYUYo6jcsENRQmXLjJIobXL4qD3TRF/JnL1ZRblxaEnEZM+p5sluxVNLGKqSO6HXV4XXagEwuiJqGnEKL8mpCtRDghrHESqh==


formula: Si8 (Mg1.18 Co3.82) (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.1065
b: 18.052
c: 5.2743
alpha: 90
beta: 104.844
gamma: 90
cell_volume: 930.143
crystal_density: 3.451
atoms_x: cJgQAADGEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAALB7AQAwgwYA8HYHACD4BQCg1hUAEPQUAGDWFADgZRQA
atoms_y: MD4FALBeCgCAnQUAgJ0FAFAECwBQBAsAAAAAAAAAAAAw3RAAMN0QAICEHgCQeQUAEJoKAAAAAAAA8Q4AYPIHAOAEBwAAAAAA
atoms_z: IF8SAKBHMQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAAB3AQDQ0gwAMLgrABC1KwCghS8AUFQGANDeIwDw/BIA
atoms_occupancy: AAk9AAAJPQBA0QwAwDcwAIBPEgCAuSoAAMQJAABFMwCAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KCo80
 Atomic parameters from ICSD

qdat:
AAAAAAAAAAACQAAAAAAAEEASIAQAAABiCIBIEACAFgjIEJEQ5AC5oNAQowyADvqQMdFMMiV4YYxaj4sINRQmeOnLJItqWxODmViF2JmNXqSbFz6InE5Mvb5clnRRVNMWqiayGmZYWbdAEg6iJSKlEKT8vKDtRDhB/HEmqh==


formula: Si8 Co5 (Na Ca) K O24 H2
compound: <missing>
formula_title: <missing>
a: 10.1166
b: 18.066
c: 5.2752
alpha: 90
beta: 104.846
gamma: 90
cell_volume: 931.945
crystal_density: 3.590
atoms_sites: ["Si1", "Si2", "Co1", "Co2", "Co3", "Na", "Ca", "K", "O1", "O2", "O-H3", "O4", "O5", "O6", "O7"]
atoms_x: YKMQAADGEQAAAAAAAAAAAAAAAAAAAAAAAAAAAKA7AQCggQYAMH0HAFCfBgDwAxYAsOoUALADFQBQSxQA
atoms_y: AEYFAOBvCgCwfAUAAAkLAAAAAABgvBAAYLwQAICEHgCgbgUAoIIKAAAAAABQug4A0AkIAFDqBgAAAAAA
atoms_z: AFwSALAjMQCAhB4AAAAAAAAAAACAhB4AgIQeAIC7AABgOA0AcPArAIBJLAAwBDAAkEEGAEBaJAAgixMA
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQCAhB4AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OE8AADhPAADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQBIngAASJ4AAEieAABIngAAqNkAAKjZAACA7QAA
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:
 Site occupancies in monoclinic amphiboles: Rietveld structure refinement of
 synthetic magnesium cobalt potassium richterite
 Sample: KCo100
 Atomic parameters from ICSD

qdat:
AAAAAAAAAAACQAAAAAAAEEASIAQAAABkCIBQEAEANgjIIJIRaACpwNAQogmADPqQMtFUNCV4owyzDpYQahRmefGVSQtumxKFEbCL2LOPm6SeLX6QvIyNubTclmSRWNMW1GbyGuZwa2dAFg7CbkMtIST0tKG1TDiBdFJGrB==


formula: Cu6 S Cl Al O19 H15
compound: <missing>
pub_title: The crystal structure of spangolite, a complex copper sulfate sheet mineral
formula_title: <missing>
a: 8.254
b: 8.254
c: 14.354
alpha: 90
beta: 90
gamma: 120
cell_volume: 846.901
crystal_density: 3.117
atoms_x: sJUFADCzMAAAAAAAVVgUAKuwKAAwMwsAAAAAAGBaMQCwPiAAIBQSAMA4AgAAsSEAgE4nAEBwMQBAWSAAgE8SAABxAgA=
atoms_y: EGAcANB4AgAAAAAAq7AoAFVYFACgHAIAAAAAAMA1DwAQJxkA0JEbAABIDQDwbgAAoOsFAEBCDwBABhkAQHcbAIBtDQA=
atoms_z: AAAAAMAx//+gSvL/8B8JAJAg//9wLPD/cJL4/yDv+v+AkAMAYDr8/0D0AgBgkA8AQEIPAEDhMwBA7wcAwBk1AABTBwA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQCAhB4AgIQeAAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: sOUAABDWAAAwugEAoBwCAKC+AACgegMAQEsBAGDqAABw3wAA4PYAAMDaAADw3wIA8N8CAIC7AACAuwAAgLsAAIC7AAA=
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
atoms_sites:
["Cu1", "Cu2", "S", "Cl", "Al", "O1", "O2", "O-h3", "O-h4", "O-h5", "O-h6", "O-H7A", "O-H7B", "H3", "H4", "H5", "H6"]

qdat:
AAAAAAAAAAAAAACAIAAACAAAAIIAAYQACAAAEADMAIABkAZAEQCADYBAAQPgYAkDYMA8CgyBA2KAUfDgUFDAcaGBx4sHHHgR4wcYIGHMDGmBFGHHHAOYM84xzDGEY5hjuE4hnOc6jcwzsIiichuZTcLERyMzC7GxsyG7Ez==


formula: O22.6 F1.4 (Si7.584 Al.416) Mg3.24 Fe1.22 Ti.05 Mn.43 Li.06 Na2.104 Ca.25 K.148
compound: Questa caldera, New Mexico
formula_title: <missing>
a: 9.795
b: 17.993
c: 5.280
alpha: 90
beta: 104.53
gamma: 90
cell_volume: 900.792
crystal_density: 3.133
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:
 Li: an important component in igneous alkali amphiboles
 Sample: A(1), magnesio-ferri-fluor-oxy-katophorite

atoms_sites:
["O1", "O2", "O3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe3+M1", "TiM1", "MnM1", "MgM2", "Fe3+M2", "MnM2", "LiM3", "MgM3", "Fe3+M3", "MnM3", "NaM4", "CaM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2"]

atoms_x:
0N0GAHA4BwBARgYAQEYGABAgFgBAUBUAQB4VAGDWFAAgTBEAIEwRAACtEQAArREAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA0NwCANDcAgAAAAAAAAAAAA==

atoms_y:
wD8FAEBHCgAAAAAAAAAAAOA4DwBgJAgA4E8HAAAAAABQKAUAUCgFAMBsCgDAbAoA8B4FAPAeBQDwHgUA8B4FAADwCgAA8AoAAPAKAAAAAAAAAAAAAAAAAAAAAABw4xAAcOMQAICEHgCAhB4AgIQeAICEHgCQfx0AkH8dAA==

atoms_z:
EFYNABBLLACQdisAkHYrAOCFMACwxwUA4OwjAMAKEgBQJRIAUCUSABAUMQAQFDEAgIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAAAAAAAAAAAAUNEGAFDRBgAAAAAAAAAAAA==

atoms_occupancy:
AAk9AAAJPQCATxIAgLkqAAAJPQAACT0AAAk9AAAJPQCA3DkAgCwDAIDcOQCALAMAABAnAKAsEACghgEAwEUEAOBQJADgyBAAQO8HAICpAwBA/y4AgIsIAMDUAQDgZzUAIKEHAIAmBACAAgoAIMUBACA2BADgqwAAQJYBAA==

atoms_u_iso:
2HIAAJiKAAAYsAAAGLAAABC4AAAQuAAAUKAAAAjAAAD4XAAA+FwAABhbAAAYWwAAWKIAAFiiAABYogAAWKIAAMh4AADIeAAAyHgAAOhiAADoYgAA6GIAAOhiAADoywAA6MsAAEBlBQBAZQUAWMgCAFjIAgCYDwMAmA8DAA==

qdat:
AAAAAAAAAAACEAAAAAAAGAQMAgIAAAAwQCAiAEBAEoSEQKEQcAhUkXEEYF4oCO0DQLINKxacAgQlRmFQAh6CayT8Y6xYFo6k7KoHVpM20h91RXatNMgFjvynwdrEHQe7Yc21MgNN2QYWCQGdgoirSGFU5Sl7QlQBuqwL6F==


formula: O22.64 F1.36 (Si7.6 Al.4) Mg3.16 Fe1.24 Ti.05 Mn.16 Zn.33 Li.06 Na1.469 Ca.95 K.169 H.18
compound: Questa caldera, New Mexico
formula_title: <missing>
a: 9.808
b: 17.993
c: 5.284
alpha: 90
beta: 104.54
gamma: 90
cell_volume: 902.630
crystal_density: 3.202
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:
 Li: an important component in igneous alkali amphiboles
 Sample: A(2), magnesio-ferri-fluor-katophorite

atoms_sites:
["O1", "O2", "O3", "O-H3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe3+M1", "TiM1", "MnM1", "MgM2", "Fe3+M2", "ZnM2", "LiM3", "MgM3", "Fe3+M3", "MnM3", "NaM4", "CaM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2"]

atoms_x:
sNoGACA9BwCgTwYAoE8GAKBPBgDwHBYAIE0VAHAWFQDAxhQAoD8RAKA/EQBwqxEAcKsRAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAALDAAgCwwAIAAAAAAAAAAAA=

atoms_y:
IEkFAGBKCgAAAAAAAAAAAAAAAADgOA8AcBkIAKBJBwAAAAAA4CkFAOApBQCgaQoAoGkKAOApBQDgKQUA4CkFAOApBQCw9AoAsPQKALD0CgAAAAAAAAAAAAAAAAAAAAAAYO4QAGDuEACAhB4AgIQeAICEHgCAhB4AMEQdADBEHQA=

atoms_z:
8FINAIBiLABwWisAcForAHBaKwAQlzAAkMQFABD+IwAgFBIAACoSAAAqEgBQGjEAUBoxAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgIQeAICEHgAAAAAAAAAAANCSBgDQkgYAAAAAAAAAAAA=

atoms_occupancy:
AAk9AAAJPQDACQ4AQH4FAACBKQAACT0AAAk9AAAJPQAACT0AwPs5AEANAwDA+zkAQA0DAECOLAAANQwAoIYBACC/AgDgjBoAAGoYACASCgCAqQMAwKgyAABxAgDARQQAIAsgAOD9HAAgNgQA4G8KAGBhAgCg6wUA4KsAAOClAQA=

atoms_u_iso:
gI4AAIiGAAAYsAAAGLAAABiwAAAoqgAACMAAAEieAADQzwAAAF8AAABfAAAAXwAAAF8AAICOAACAjgAAgI4AAICOAADIeAAAyHgAAMh4AADYcgAA2HIAANhyAADYcgAAMKwAADCsAACAjwQAgI8EANj3AgDY9wIAgF8CAIBfAgA=

qdat:
AAAAAAAAAAACEAAAAAAAGAgMAgQAAAAwgCAiAICAEoUEwKEQcBBUkVIEYF4oCO8GQPQZMxacAghpjuHQAheEb0XcQ0xoHo0lWLQL9qIkojVaSb61VJAOm/1PgXTMGg8uo5bacgXauQYkCgErBRDVkKLk6tHzhGgDbTQP0F==


formula: O22.3 (F1.7 Si7.672) Al.328 Mg.54 Fe2.98 Mn.7 Ti.08 Zn.06 Li.64 Na2.662 K.238 H.3
compound: Questa caldera, New Mexico
pub_title: Li: an important component in igneous alkali amphiboles Sample: A(3), ferro-fluor-leakeite
formula_title: <missing>
a: 9.792
b: 17.934
c: 5.313
alpha: 90
beta: 103.87
gamma: 90
cell_volume: 905.810
crystal_density: 3.353
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
atoms_sites:
["O1", "O2", "O-H3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe2+M1", "MnM1", "Fe2+M2", "Fe3+M2", "TiM2", "ZnM2", "LiM3", "MgM3", "MnM3", "NaM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2"]

atoms_x:
sMEGAOBPBwCg5QYAoOUGAEBKFgCwZxUAENsUAMB7FABQEhEAUBIRAPC3EQDwtxEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIDIAgCAyAIAAAAAAAAAAAA=

atoms_y:
oIcFALB3CgAAAAAAAAAAAJA9DwBA1gcAkFQHAAAAAACgPAUAoDwFADBrCgAwawoAgGsFAIBrBQCAawUAsA0LALANCwCwDQsAsA0LAAAAAAAAAAAAAAAAAIDxEACAhB4AgIQeAICEHgCAhB4A0KQcANCkHAA=

atoms_z:
gL4MAID4LABwKCsAcCgrAFDoMABAGgUAUG4jAABDEgBgzxEAYM8RAID5MACA+TAAgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgAAAAAAAAAAAFDwBQBQ8AUAAAAAAAAAAAA=

atoms_occupancy:
AAk9AAAJPQDAJwkAQOEzAAAJPQAACT0AAAk9AAAJPQBgiDoAoIACAGCIOgCggAIAQEIPAAAuIgDAmAsAgDgBAMCKNwAAcQIAwNQBAAAQJwAAcQIAAIgTAAAJPQAA6AMAgPwKAOAQBQDACQ4AgD4AAOCrAAA=

atoms_u_iso:
mIAAALh+AACQ3QAAkN0AAFCgAABYogAAUKAAADCsAAAYWwAAGFsAABBZAAAQWQAAsHwAALB8AACwfAAA2GgAANhoAADYaAAA2GgAAKiEAACohAAAqIQAALDbAAC4wQMAuMEDAJC4AgCQuAIAKNoCACjaAgA=

qdat:
AAAAAAAAAAACEAAAAAAAKAgMAggAAABwQMAoAICAGIIQwkTBoBCjmKgJILMQHFoISUjaDEXQAaFYZJqQA80ZeEcYb1JSYrhlopAeyeydRO0Yq1eeaEYLv6WqlVZEjrTZrNU0QvXtBxsmgukGoO6IwvhLYmEDSAjwuCbQ4U==


formula: O22.4 (F1.6 Si7.8) Al.2 Mg.64 Fe2.92 Mn.66 Ti.07 Zn.07 Li.64 Na2.652 K.239 H.4
compound: Questa caldera, New Mexico
pub_title: Li: an important component in igneous alkali amphiboles Sample: A(4), ferro-fluor-leakeite
formula_title: <missing>
a: 9.796
b: 17.934
c: 5.312
alpha: 90
beta: 103.89
gamma: 90
cell_volume: 905.931
crystal_density: 3.340
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
atoms_sites:
["O1", "O2", "O-H3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe2+M1", "MnM1", "Fe2+M2", "Fe3+M2", "TiM2", "ZnM2", "LiM3", "MgM3", "MnM3", "NaM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2"]

atoms_x:
sMEGAFBOBwCw2gYAsNoGALBIFgCQZBUAwN8UAOB+FABQEhEAUBIRAGC2EQBgthEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHC6AgBwugIAAAAAAAAAAAA=

atoms_y:
gIQFACB2CgAAAAAAAAAAACA/DwBA1gcAIFYHAAAAAACgPAUAoDwFADBrCgAwawoAgGsFAIBrBQCAawUAIAwLACAMCwAgDAsAIAwLAAAAAAAAAAAAAAAAAPDvEACAhB4AgIQeAICEHgCAhB4A0HIcANByHAA=

atoms_z:
UMYMALDwLAAwIisAMCIrAMDmMAAgFwUA4G8jADA7EgCA0hEAgNIRABD7MAAQ+zAAgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgAAAAAAAAAAALDgBQCw4AUAAAAAAAAAAAA=

atoms_occupancy:
AAk9AAAJPQAANQwAANQwAAAJPQAACT0AAAk9AAAJPQBggjsAoIYBAGCCOwCghgEAgE8SAEBZIABAYAoAwNQBAIDuNgDgIgIA4CICAAAQJwAAcQIAAIgTAAAJPQCg9wMAQN0KAEABBQAArA0AIE4AACDLAAA=

atoms_u_iso:
yHgAAMh4AADoywAA6MsAAGCaAABYmAAAcJQAAECmAAAgUwAAIFMAABhRAAAYUQAAuHQAALh0AAC4dAAAAF8AAABfAAAAXwAAAF8AAKCCAACgggAAoIIAAJDnAAAgoAMAIKADACCDAgAggwIAqJcBAKiXAQA=

qdat:
AAAAAAAAAAACEAAAAAAAKAgMAggAAABwQMAoAICAGIIQgkTBoBCjmKgJILMQFjoISUjaFG3QAaFYZJqgA8UZdE8QXVJSYqhlopAeyNydRO0cqt+dckUNu5WqlVJGTrRZpM00QnVdBRs1geUGoO6IwnhL4mEDSAjwuCfQUc==


formula: O22.4 (F1.6 Si7.728) Al.272 Mg.46 Fe3.04 Mn.73 Ti.07 Zn.07 Li.63 Na2.647 K.236 H.4
compound: Questa caldera, New Mexico
pub_title: Li: an important component in igneous alkali amphiboles Sample: A(5), ferro-fluor-leakeite
formula_title: <missing>
a: 9.792
b: 17.935
c: 5.314
alpha: 90
beta: 103.85
gamma: 90
cell_volume: 906.109
crystal_density: 3.361
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
atoms_sites:
["O1", "O2", "O-H3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe2+M1", "MnM1", "Fe3+M2", "TiM2", "ZnM2", "LiM3", "MgM3", "MnM3", "NaM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2"]

atoms_x:
QMMGAABTBwCg5QYAoOUGAGBNFgAgZhUAgNkUAIB1FADAEBEAwBARAIC5EQCAuREAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAkL0CAJC9AgAAAAAAAAAAAA==

atoms_y:
MIkFAGB8CgAAAAAAAAAAAAA8DwBA1gcAIFYHAAAAAAAwPgUAMD4FAMBsCgDAbAoAEG0FABBtBQAQbQUAsA0LALANCwCwDQsAAAAAAAAAAAAAAAAAgPEQAICEHgCAhB4AgIQeAICEHgDg5BwA4OQcAA==

atoms_z:
gL4MAFAALQCwLisAsC4rADDlMABwEgUAwGwjADA7EgBAzBEAQMwRAKD8MACg/DAAgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgIQeAAAAAAAAAAAAUAkGAFAJBgAAAAAAAAAAAA==

atoms_occupancy:
AAk9AAAJPQAANQwAANQwAAAJPQAACT0AAAk9AAAJPQDA9ToAQBMCAMD1OgBAEwIAQNEMAMACJAAANQwAQMM4AOAiAgDgIgIAwHMmAABxAgBAJBQAAAk9AICpAwAgEgoAQAEFAACsDQDAXQAAoAkBAA==

atoms_u_iso:
uHQAAKh6AADA1QAAwNUAAGCaAABonAAAaJIAAEioAAAIVwAACFcAACBTAAAgUwAAyHgAAMh4AADIeAAA6GIAAOhiAADoYgAAuH4AALh+AAC4fgAAmN8AADhQBAA4UAQAeLwCAHi8AgBgrQEAYK0BAA==

qdat:
AAAAAAAAAAACEAAAAAAAKAgMAggAAABwQMAoAICAGIIQwkTBoBCjmKgKILMQHFoIS0iaFEWQAaFY5JqgA80ZuI8Qf5JUorhnIpAeifSfRO0YrVeeckYNP6WqlVZEivSarJc8QvVqCxsmgukOoe6QxPjLwmMDyAnxcCfQ4U==


formula: O22.62 F1.38 (Si7.792 Al.208) Mg2.1 Fe2.14 Ti.04 Mn.54 Zn.02 Li.16 Na1.91 Ca.72 K.211 H.22
compound: Questa caldera, New Mexico
formula_title: <missing>
a: 9.835
b: 17.944
c: 5.297
alpha: 90
beta: 103.97
gamma: 90
cell_volume: 907.161
crystal_density: 3.289
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:
 Li: an important component in igneous alkali amphiboles
 Sample: A(6), magnesio-ferri-fluor-katophorite

atoms_sites:
["O1", "O2", "O3", "O-H3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe3+M1", "TiM1", "MnM1", "MgM2", "Fe2+M2", "Fe3+M2", "ZnM2", "LiM3", "MgM3", "Fe2+M3", "Fe3+M3", "MnM3", "NaM4", "CaM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2"]

atoms_x:
cNQGAHBRBwAAiwYAAIsGAACLBgAgLhYAoEAVAGDvFAAQqRQA0B4RANAeEQAwpREAMKURAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAUJ4CAFCeAgAAAAAAAAAAAA==

atoms_y:
8FAFALBeCgAAAAAAAAAAAAAAAADQKg8AYPIHACA9BwAAAAAAkC4FAJAuBQCAZgoAgGYKAMBxBQDAcQUAwHEFAMBxBQAACQsAAAkLAAAJCwAACQsAAAAAAAAAAAAAAAAAAAAAAAAAAAAQ2hAAENoQAICEHgCAhB4AgIQeAICEHgCgQh0AoEIdAA==

atoms_z:
sBoNADCALACgUisAoFIrAKBSKwAAiTAAoFUFAMC3IwCA6xEAEO0RABDtEQBQ6DAAUOgwAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAAAAAAAAAAAA4NgFAODYBQAAAAAAAAAAAA==

atoms_occupancy:
AAk9AAAJPQAANQwAwLYGAEAdKgAACT0AAAk9AAAJPQAACT0AwHI7AECWAQDAcjsAQJYBAODBJgDAtgYAgDgBAOBXDgCAiwgAoPAZAKDwGQBAnAAAAMQJAMCRIQAAxAkAgKkDAMBFBAAAECcAAPkVAOAWBABAVAwAYFsDAIACCgCgCQEAQA0DAA==

atoms_u_iso:
eIwAAFiiAAAItgAACLYAAAi2AADgyQAA+LsAAAi2AADoywAACGEAAAhhAADwZAAA8GQAALh+AAC4fgAAuH4AALh+AAC4dAAAuHQAALh0AAC4dAAAeJYAAHiWAAB4lgAAeJYAAHiWAAAgBwEAIAcBANDtBQDQ7QUA2KICANiiAgAYqAMAGKgDAA==

qdat:
AAAAAAAAAAACEAAAAAAAKAgMBAgAAABwgMAoAICAHIIRgoSgoCCimKgRQKMgFT4QhdDyErPQAkMotplACc4I9pahmqViM11UlKBa7lWqUenrF3cr2wGTttn4bWPFJNk4y5bZgO8YgVJFwLuVkOTYUHw/yPjiXAS4KAnoFD==


formula: O22.4 (F1.6 Si7.704) Al.296 Mg2.57 Fe1.72 Ti.04 Mn.63 Zn.04 Li.08 Na1.864 Ca.72 K.166 H.4
compound: Questa caldera, New Mexico
formula_title: <missing>
a: 9.861
b: 18.050
c: 5.288
alpha: 90
beta: 104.22
gamma: 90
cell_volume: 912.377
crystal_density: 3.239
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:
 Li: an important component in igneous alkali amphiboles
 Sample: A(7), magnesio-ferri-fluor-katophorite

atoms_sites:
["O1", "O2", "O-H3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe3+M1", "TiM1", "MnM1", "MgM2", "Fe2+M2", "Fe3+M2", "MnM2", "ZnM2", "LiM3", "MgM3", "Fe2+M3", "MnM3", "NaM4", "CaM4", "MnM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2"]

atoms_x:
ANYGAOBPBwDQeQYA0HkGAFAmFgCAPRUAMPcUANC7FAAQJREAECURAKCjEQCgoxEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAwGoCAMBqAgAAAAAAAAAAAA==

atoms_y:
cEQFAJBbCgAAAAAAAAAAANAqDwDA+wcAUDUHAAAAAABwKwUAcCsFABBoCgAQaAoAwHEFAMBxBQDAcQUAwHEFAMACCwDAAgsAwAILAMACCwDAAgsAAAAAAAAAAAAAAAAAAAAAAKDbEACg2xAAoNsQAICEHgCAhB4AgIQeAICEHgAgTx0AIE8dAA==

atoms_z:
MCcNAFBqLACAaCsAgGgrAABwMADwaQUAgMojAKDVEQCQ+REAkPkRAODpMADg6TAAgIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AgIQeAAAAAAAAAAAAQMkFAEDJBQAAAAAAAAAAAA==

atoms_occupancy:
AAk9AAAJPQAANQwAANQwAAAJPQAACT0AAAk9AAAJPQDgxjoAIEICAODGOgAgQgIA4KMrAOAiAgCAOAEAwAkOAEDRDAAA2xoAQLMRAABxAgCAOAEAAOIEAADyKwDAmAsAQJwAAACfJAAA+RUAAHECAABrAwDAjA0AgK8CAKDNCgDgqwAAgK8CAA==

atoms_u_iso:
gI4AAHiWAAAItgAACLYAANjHAADowQAACLYAAAC+AAD4XAAA+FwAAAhhAAAIYQAAuHQAALh0AAC4dAAAuHQAALh0AAC4dAAAuHQAALh0AAC4dAAAyG4AAMhuAADIbgAAyG4AAIDtAACA7QAAgO0AAGgPBgBoDwYASM4CAEjOAgCgEQMAoBEDAA==

qdat:
AAAAAAAAAAACIAAAAAAAEBAUBAQAAABggMBIAQEALQkRAYUhoEDKSKgggWigEvoRAeD1RK1wCGIqVw6AELkK8tdCPjHBdKqGRsBzYhZuJuzEieezxwBxr+OwLbHSiT1IY2+lQDfGoH/AsF52ImY6JjsPqTspFwDPDwKtBY==


formula: O22.8 F1.2 (Si7.88 Al.12) Mg.2 Fe3.57 Mn.67 Ti.1 Zn.1 Li.36 Na2.47 K.245 H.8
compound: Questa caldera, New Mexico
pub_title: Li: an important component in igneous alkali amphiboles Sample: A(8)
formula_title: <missing>
a: 9.816
b: 18.004
c: 5.325
alpha: 90
beta: 103.72
gamma: 90
cell_volume: 914.220
crystal_density: 3.394
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
atoms_sites:
["O1", "O2", "O3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe2+M1", "MnM1", "Fe2+M2", "Fe3+M2", "TiM2", "ZnM2", "LiM3", "Fe2+M3", "MnM3", "NaM4", "KA", "NaA", "KAm", "NaAm", "H"]

atoms_x:
EMsGAJBUBwDAzwYAwM8GANBLFgCgWRUAcMsUAMBiFACQGBEAkBgRAPC3EQDwtxEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADuAgAA7gIAUP4LAA==

atoms_y:
EIYFAIB/CgAAAAAAAAAAAKAyDwAg0wcAsFcHAAAAAAAQOwUAEDsFAIBmCgCAZgoAoIcFAKCHBQCghwUAICULACAlCwAgJQsAICULAAAAAAAAAAAAAAAAAIDxEACAhB4AgIQeAICEHgCAhB4AAAAAAA==

atoms_z:
EKcMANDzLAAQOCsAEDgrAADUMAAw8wQA8EsjALAuEgCgvBEAoLwRAMDmMADA5jAAgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgAAAAAAAAAAAHBwBgBwcAYAkLssAA==

atoms_occupancy:
AAk9AAAJPQAAahgAAJ8kAAAJPQAACT0AAAk9AAAJPQCgHjwAYOoAAKAePABg6gAAgBoGAACBKQCAbQ0AQO8HAED/LgBADQMAQA0DAAD5FQBABhkAwAkOAAAJPQBgzAUAwBsLAOCTBAAAyggAAGoYAA==

atoms_u_iso:
qIQAAJiKAAD4xQAA+MUAACi0AAAYsAAAOK4AABi6AAAAXwAAAF8AAPhcAAD4XAAAyHgAAMh4AADIeAAA6GwAAOhsAADobAAA6GwAAKh6AACoegAAqHoAAFD1AAC43gQAuN4EAMhJAgDISQIA+LMDAA==

qdat:
AAAAAAAAAAACEAAAAAAASAgIBBAAAADQgUBQAIEAMQQhhEmDQCGFMlAUQWRAWLQQlxEkKJ9ABYNhkmpACxRlURxhbUlRiuGcikB6JdJ9EvTS9V650Rh9vJys6moSPabNNqmkF67oONmsFywzB6yGE4JeFxAygE8Pgj8HGj==


formula: O22.6 F1.4 (Si7.88 Al.12) Mg.18 Fe3.52 Mn.79 Ti.08 Zn.1 Li.33 Na2.404 K.257 H.6
compound: Questa caldera, New Mexico
pub_title: Li: an important component in igneous alkali amphiboles Sample: A(9)
formula_title: <missing>
a: 9.815
b: 18.016
c: 5.329
alpha: 90
beta: 103.71
gamma: 90
cell_volume: 915.463
crystal_density: 3.394
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
atoms_sites:
["O1", "O2", "O3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe2+M1", "MnM1", "Fe2+M2", "Fe3+M2", "TiM2", "ZnM2", "LiM3", "Fe2+M3", "MnM3", "NaM4", "KA", "NaA", "KAm", "NaAm", "H"]

atoms_x:
8McGACBWBwBw1AYAcNQGAIBQFgCAVhUAwMYUAEBWFACQGBEAkBgRAPC3EQDwtxEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADC0AgAwtAIAQFQMAA==

atoms_y:
UIwFABCBCgAAAAAAAAAAAKAyDwCw1AcAsFcHAAAAAACgPAUAoDwFAIBmCgCAZgoAoIcFAKCHBQCghwUAsCYLALAmCwCwJgsAsCYLAAAAAAAAAAAAAAAAAMD3EACAhB4AgIQeAICEHgCAhB4AAAAAAA==

atoms_z:
8KMMAAAFLQCgOSsAoDkrAJDVMADg9wQA0EgjABA4EgDAvxEAwL8RACDwMAAg8DAAgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgAAAAAAAAAAAJBaBgCQWgYAQHwvAA==

atoms_occupancy:
AAk9AAAJPQCATxIAgLkqAAAJPQAACT0AAAk9AAAJPQCgHjwAYOoAAKAePABg6gAAQH4FAAAQJwDAehAAgBoGAEBwMQAAcQIAQA0DAEAkFACAohkAQEIPAAAJPQCg5QYAQN0KAABlBACg5QYAgE8SAA==

atoms_u_iso:
qIQAAJiKAACQ3QAAkN0AACiqAABIqAAAKKoAABi6AAD4XAAA+FwAABhbAAAYWwAAsHwAALB8AACwfAAAyG4AAMhuAADIbgAAyG4AALB8AACwfAAAsHwAAIDtAAAQNQYAEDUGADB9AgAwfQIAIAcBAA==

qdat:
AAAAAAAAAAACEAAAAAAASAgIBBAAAADggUBQAIEAMQQgiEmDQCKGMlAUQWxAWPQwlxMsOJ9ABoNhkmpACxRq4RxhTklTiuG9EkC6ZVKtEujjdVq5UShdrRyouuokdqbVZKmkF63wUXk0FlhmD9SEJYa2JhA0gE8bAn0OFH==


formula: O22.3 (F1.7 Si8) Mg.77 Fe3.06 Mn.81 Ti.12 Li.25 Na2.799 Ca.008 K.179 H.3
compound: Questa caldera, New Mexico
pub_title: Li: an important component in igneous alkali amphiboles Sample: A(10)
formula_title: <missing>
a: 9.858
b: 18.046
c: 5.316
alpha: 90
beta: 103.69
gamma: 90
cell_volume: 918.836
crystal_density: 3.352
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
atoms_sites:
["O1", "O2", "O-H3", "F", "O4", "O5", "O6", "O7", "SiT1", "SiT2", "MgM1", "Fe2+M1", "MnM1", "Fe2+M2", "Fe3+M2", "TiM2", "LiM3", "MgM3", "Fe2+M3", "MnM3", "NaM4", "CaM4", "MnM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2"]

atoms_x:
8OAGAGBcBwAQsgYAELIGAIA3FgCwThUAUOEUAACbFABgIBEAILARAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAFC3AgBQtwIAAAAAAAAAAAA=

atoms_y:
kGAFADBrCgAAAAAAAAAAAEApDwDgzAcAQEAHAAAAAACwMQUAQGAKAKCHBQCghwUAoIcFAHAgCwBwIAsAcCALAAAAAAAAAAAAAAAAAAAAAAAQ2hAAENoQABDaEACAhB4AgIQeAICEHgCAhB4AsIgcALCIHAA=

atoms_z:
YNQMAICtLAAAQysAAEMrAFCdMADg3gQAYEojABDtEQBgthEAQMEwAICEHgCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAICEHgAAAAAAAAAAANDjBQDQ4wUAAAAAAAAAAAA=

atoms_occupancy:
AAk9AAAJPQDAJwkAQOEzAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AIDeDwBAdxsAQLMRAMCvHADArxwAgKkDAEBCDwBAQg8AABcRAIBtDQBgfDwAgD4AACBOAADgnwIAIAYMAADoAwBAsxEAgD4AAIA4AQA=

atoms_u_iso:
cJQAAFCgAACw2wAAsNsAALDbAAAYugAAAL4AAOjBAAAIYQAAAF8AALh0AAC4dAAAuHQAANBwAADQcAAA0HAAAKh6AACoegAAqHoAAKh6AABQ/wAAUP8AAFD/AACYbgMAmG4DAJi6AgCYugIA8LEDAPCxAwA=

qdat:
AAAAAAAAAAACIAAAAAAAMBAYBBAAAADhAYBQAQEAMQxDBRGDgEGKYuAlAoxAVPhhGyLIUq/ACQrDnK0AJ1BHtHyE9VEjmuakqQH27czkj42ZW5qtSBm5JJ+G7ixRXZUMsc2YHWPQGSi4HrkyFy0NHYdaG5iTAS8XAjyJGV==


formula: O22.3 (F1.7 Si7.96) Al.04 Mg.62 Fe3.21 Mn.91 Ti.12 Li.25 Na2.663 Ca.06 K.159 H.3
compound: Questa caldera, New Mexico
pub_title: Li: an important component in igneous alkali amphiboles Sample: A(11)
formula_title: <missing>
a: 9.859
b: 18.049
c: 5.316
alpha: 90
beta: 103.69
gamma: 90
cell_volume: 919.082
crystal_density: 3.381
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
atoms_sites:
["O1", "O2", "O-H3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe2+M1", "MnM1", "Fe2+M2", "Fe3+M2", "TiM2", "LiM3", "MgM3", "Fe2+M3", "MnM3", "NaM4", "CaM4", "MnM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2"]

atoms_x:
YN8GAPBdBwAwtQYAMLUGADA8FgCwThUAMN4UAHCZFADQHhEA0B4RACCwEQAgsBEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgK8CAICvAgAAAAAAAAAAAA==

atoms_y:
QGUFAFBuCgAAAAAAAAAAAEApDwDgzAcA0EEHAAAAAACwMQUAsDEFAEBgCgBAYAoAwIoFAMCKBQDAigUAACILAAAiCwAAIgsAAAAAAAAAAAAAAAAAAAAAABDaEAAQ2hAAENoQAICEHgCAhB4AgIQeAICEHgBgphwAYKYcAA==

atoms_z:
kMwMAMCzLAAwOysAMDsrACClMAAw2gQAQEcjAMDxEQDQtBEA0LQRANDCMADQwjAAgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AgIQeAAAAAAAAAAAA0PwFAND8BQAAAAAAAAAAAA==

atoms_occupancy:
AAk9AAAJPQDAJwkAQOEzAAAJPQAACT0AAAk9AAAJPQDgujwAIE4AAOC6PAAgTgAAQNEMAICEHgBAsxEAgIQeAADbGgCAqQMAQEIPAAA1DABAJBQAgG0NAODYNwDA1AEAYFsDAGBhAgAggwwAAGsDAMDxEQCAPgAAgDgBAA==

atoms_u_iso:
eIwAAHiWAAC40wAAuNMAANDPAAA4rgAAILIAAPjFAAAYWwAAGFsAABhbAAAYWwAA2HIAANhyAADYcgAA6GwAAOhsAADobAAAsHwAALB8AACwfAAAsHwAADALAQAwCwEAMAsBAMBkAwDAZAMA8JQCAPCUAgDQ7AEA0OwBAA==

qdat:
AAAAAAAAAAACIAAAAAAAMBAYBBAAAADhAYBQAQEAMQxDBRGDgEGKYuAlAoxAVPhBGyLIUq/ACQrDnK0AJ1BHtHyE9VEjmubsqQH27czkj42ZW5qtSBm5JJ+G7CxRXZUcsc2QHWPQGSi4HrkyFy0NHYdaG5iTAS8XAjyJGV==


formula: O23.2 F.8 (Si7.824 Al.176) Mg.31 Fe3.87 Mn.58 Ti.08 Zn.04 Li.17 Na2.415 Ca.08 K.223 H1.2
compound: Questa caldera, New Mexico
pub_title: Li: an important component in igneous alkali amphiboles Sample: A(12)
formula_title: <missing>
a: 9.840
b: 18.036
c: 5.365
alpha: 90
beta: 104.05
gamma: 90
cell_volume: 923.665
crystal_density: 3.389
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
atoms_sites:
["O1", "O2", "O3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe2+M1", "MnM1", "Fe2+M2", "Fe3+M2", "TiM2", "ZnM2", "LiM3", "MgM3", "Fe2+M3", "MnM3", "NaM4", "CaM4", "FeM4", "KA", "NaA", "KAm", "NaAm", "H"]

atoms_x:
8McGACBWBwCAyQYAgMkGAJBFFgAAShUAUMgUAFBkFACQGBEAkBgRALCxEQCwsREAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAMDnAgDA5wIAcBoMAA==

atoms_y:
8IIFAIB/CgAAAAAAAAAAAIAvDwCw1AcAAFMHAAAAAAAQOwUAEDsFABBoCgAQaAoAwIoFAMCKBQDAigUA0CkLANApCwDQKQsA0CkLAAAAAAAAAAAAAAAAAAAAAAAg6BAAIOgQACDoEACAhB4AgIQeAICEHgCAhB4AAAAAAA==

atoms_z:
cLAMANDaLABAMCsAQDArACC+MADg3gQA0EgjAKAgEgBgthEAYLYRACDXMAAg1zAAgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAICEHgAAAAAAAAAAADAABwAwAAcAAJstAA==

atoms_occupancy:
AAk9AAAJPQAAnyQAAGoYAAAJPQAACT0AAAk9AAAJPQBAsTsAwFcBAECxOwDAVwEAwLYGAADyKwBAYAoAQLMRAECsJwAAcQIAgDgBAEBgCgBAfgUAgIQeAACmDgBgETkAAHECAKCGAQDgEAUA4GMMAMBFBADgbwoAAJ8kAA==

atoms_u_iso:
gI4AAHiMAAD4xQAA+MUAABi6AAAQuAAAKLQAAPjFAAAYWwAAGFsAAAhhAAAIYQAAwHYAAMB2AADAdgAA0HAAANBwAADQcAAA0HAAALh0AAC4dAAAuHQAALh0AADwGAEA8BgBAPAYAQAQpwcAEKcHAMjqAQDI6gEAmD4BAA==

qdat:
AAAAAAAAAAACIAAAAAAASAgQBBAAAAGggUBQAQIAURQhCIkFQCKONZAYgUxAoVgxSRZIMz6ABINjRspAF6VTwThDfRRplca6EkFdbYUoh/FDqbvmUsFW7GlT3ILgyzT7JstEW2tBwdeEbLHCrqKaaVltKYBiANizC6KQjD==


formula: O23.7 F.3 Si7.928 Al.112 Mg.04 Fe4.48 Ti.06 Zn.02 Li.22 Mn.14 Na2.231 Ca.05 K.521 H1.7
compound: <missing>
pub_title: Li: an important component in igneous alkali amphiboles Sample: A(13)
formula_title: <missing>
a: 9.986
b: 18.042
c: 5.314
alpha: 90
beta: 103.92
gamma: 90
cell_volume: 929.293
crystal_density: 3.397
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
atoms_sites:
["O1", "O2", "O3", "F", "O4", "O5", "O6", "O7", "SiT1", "AlT1", "SiT2", "AlT2", "MgM1", "Fe2+M1", "Fe2+M2", "Fe3+M2", "TiM2", "ZnM2", "AlM2", "LiM3", "Fe2+M3", "MnM3", "NaM4", "CaM4", "KA", "NaA", "KAm", "NaAm", "KA2", "NaA2", "H"]

atoms_x:
ULgGACBWBwCgmgYAoJoGAIA3FgAQDRUAAJsUAMD+EwDgyBAA4MgQALB/EQCwfxEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgWwIAIFsCAAAAAAAAAAAA4GkLAA==

atoms_y:
kJIFAOCICgAAAAAAAAAAADAbDwBAvQcAcDgHAAAAAADAPwUAwD8FAMBsCgDAbAoAUIwFAFCMBQBwOQsAcDkLAHA5CwBwOQsAcDkLAAAAAAAAAAAAAAAAAKD0EACg9BAAgIQeAICEHgCAhB4AgIQeAMCvHADArxwAAAAAAA==

atoms_z:
UK0MAEDALAAQOCsAEDgrAIDHMABA6AQAYHwjAMAjEgBQwREAUMERAODQMADg0DAAgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AAAAAAAAAAAAQuAUAELgFAAAAAAAAAAAAgKctAA==

atoms_occupancy:
AAk9AAAJPQBA4TMAwCcJAAAJPQAACT0AAAk9AAAJPQBgfDwAoIwAAGB8PACgjAAAgDgBAIDQOwCAwBQAAJ8kAMDUAQBAnAAAgDgBAIBtDQAAECcAgIsIAGCCOwCghgEAoAIXAOBjDADgmQMAAPQBACDLAABgbQAAQOEzAA==

atoms_u_iso:
YJoAAECmAADwwwAA8MMAAODJAAAoqgAACLYAAOjLAADobAAA6GwAAOhsAADobAAAiJAAAIiQAAC4dAAAuHQAALh0AAC4dAAAuHQAAIiGAACIhgAAiIYAABANAQAQDQEAQHcCAEB3AgBAgQIAQIECAMBRAgDAUQIAWKIAAA==

qdat:
AAAAAAAAAAACIAAAAAAAMCAYEBAAAADiAgBgBAIAKg0UBCFBggKSgcIEBgkAZesEHRj0HK/AMcSR1ngBKwjkeZs1IvFJpWTWoI1rJldI7s0LiasyQFTco3QtljaS/06yWxrIfsVIfYSUnsk5pyaFpV6WJNQlCk2xDDpJj1==


formula: Na.36 K.37 Ca1.94 Mg1.8 Fe2.76 Al2.3 Ti.06 Si6.08 O23.74 F.26 H1.74
compound: Nuptse Glacier moraine, Everest Massif, Nepal
pub_title: The mechanism of Cl incorporation in amphibole Sample: Cl(0)
formula_title: <missing>
a: 9.895
b: 18.119
c: 5.332
alpha: 90
beta: 105.17
gamma: 90
cell_volume: 922.649
crystal_density: 3.314
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
atoms_sites:
["NaA", "KA", "NaAm", "KAm", "NaA2", "KA2", "Ca4", "Na4", "Mg1", "Fe1", "Mg2", "Fe2", "Al2", "Ti2", "Mg3", "Fe3", "Si1", "Al1", "Si2", "O1", "O2", "F3", "O-h3", "O4", "O5", "O6", "O7", "H"]

atoms_x:
AAAAAAAAAAAADQIAAA0CAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAPAIEQDwCBEAcMQRADBqBgBwUQcAELIGABCyBgBgfxYAIE0VACDpFACAXBQAMKMJAA==

atoms_y:
gIQeAICEHgCAhB4AgIQeAKDFHACgxRwAgCMRAIAjEQCQeQUAkHkFAEDdCgBA3QoAQN0KAEDdCgAAAAAAAAAAAMA/BQDAPwUAQJIKAHCPBQDAtwoAAAAAAAAAAACwQA8AAH8IADBLBwAAAAAAAAAAAA==

atoms_z:
AAAAAAAAAADgegQA4HoEAAAAAAAAAAAAgIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACB4EgAgeBIAwK4xAFARDQDg6CwAAHUrAAB1KwBAXTAAcKIGAODmJADwnhEAsGcuAA==

atoms_occupancy:
gBoGAEDvBwBADQMAgKkDAEANAwCAqQMAQDQ7AMDUAQCAExwAgPUgAMB6EADAIB8AwJgLAMDUAQCAwBQAgEgoAAC9HwAATB0AAAk9AAAJPQAACT0AQO8HAMAZNQAACT0AAAk9AAAJPQAACT0AwBk1AA==

atoms_u_iso:
ULMBAFCzAQBgWAEAYFgBAGghAwBoIQMAcJQAAHCUAADYcgAA2HIAAOhiAADoYgAA6GIAAOhiAADYaAAA2GgAABBZAAAQWQAAGFsAAGicAACYigAAQKYAAECmAABYogAAMKwAACi0AABg7wAA0C4BAA==

qdat:
AAAAAAAAAAAEIAAAAAAAMAgYBAQAAABBAKCEAQEATgoJAYZBoEExY8QQgVggI/wOArB0TG6wEBKSNoeAIPwgnQ72GyHAOCoT0rBTzVrOqrmNKm7diaBka9lvDWqh4Fnqjk3T0B77pDBwWAmmIFeMUyZVGXHICiAX4dBaMK==


formula: Na.67 K.36 Mg1.76 Fe2.94 Al1.88 Ti.04 Ca1.74 Si6.44 O25.16 Cl.56 F.26 H1.16
compound: Sesia-Lanzo marble, Western Alps, Italy
pub_title: The mechanism of Cl incorporation in amphibole Sample: Cl(1)
formula_title: <missing>
a: 9.884
b: 18.143
c: 5.332
alpha: 90
beta: 104.86
gamma: 90
cell_volume: 924.184
crystal_density: 3.479
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
atoms_sites:
["NaA", "KA", "NaAm", "KAm", "NaA2", "KA2", "Mg1", "Fe1", "Mg2", "Fe2", "Al2", "Ti2", "Mg3", "Fe3", "Ca4", "Na4", "Mg4", "Fe4", "Si1", "Al1", "Si2", "O1", "O2", "Cl3", "F3", "O-H3", "O3*", "O4", "O5", "O6", "O7"]

atoms_x:
AAAAAAAAAADAgwIAwIMCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA0AURANAFEQBQwREAYHsGAKBiBwDQeQYA0HkGANB5BgDAvQkAcHQWAMBDFQAg6RQAcIAUAA==

atoms_y:
gIQeAICEHgCAhB4AgIQeAGApHABgKRwAEJ8FABCfBQAw6AoAMOgKADDoCgAw6AoAAAAAAAAAAADAEBEAwBARAMAQEQDAEBEAYDYFAGA2BQCQjQoA8IIFAKC0CgAAAAAAAAAAAAAAAAAAAAAAcDoPALBRCACQVAcAAAAAAA==

atoms_z:
AAAAAAAAAACQxAUAkMQFAAAAAAAAAAAAgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAICEHgCAhB4AQEkSAEBJEgBAcDEAMA4NAHDRLABAMCsAQDArAEAwKwBAwCwAgHwwAHAlBgCgfCQAcMQRAA==

atoms_occupancy:
wCcJAABTBwAA4gQAgKkDAADiBACAqQMAwFwVAECsJwCAMRcAANsaAADECQCAOAEAgN4PAIAqLQDAGTUAgBoGAIA4AQBAnAAAQDslAMDNFwAACT0AAAk9AAAJPQAAFxEAQO8HAIBmIwAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
aIoDAGiKAwAwmgMAMJoDAMBRAgDAUQIAkIgAAJCIAADAdgAAwHYAAMB2AADAdgAAiJAAAIiQAAAQuAAAELgAABC4AAAQuAAA+GYAAPhmAADYaAAAGLAAAECmAADoywAA6MsAAOjLAACIRAEAILIAAAC+AADgyQAAaPEAAA==

qdat:
AAAAAAAAAAAEIAAAAAAAMAgYBAQAAABBAMCIAQEAShILAYSBwEFSxYQRAnBAI1gaBVDo2LVQEGMscw6AIdwiki/GNkSA+FIrKaB/eTJZYnMcZfa3lYCpt1S0FUnFQLNqOZsvQH1OkYLiYGaRwl8xONrc6c0geQBXRoNxRR==


formula: Na.5 K.54 Mg1.06 Fe3.58 Al2.18 Ti.02 Ca1.86 Si6.16 O24.88 (Cl.98 F.14 H.88)
compound: Sesia-Lanzo marble, Western Alps, Italy
pub_title: The mechanism of Cl incorporation in amphibole Sample: Cl(2)
formula_title: <missing>
a: 9.922
b: 18.219
c: 5.360
alpha: 90
beta: 104.81
gamma: 90
cell_volume: 936.733
crystal_density: 3.552
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
atoms_sites:
["NaA", "KA", "NaAm", "KAm", "NaA2", "KA2", "Mg1", "Fe1", "Mg2", "Fe2", "Al2", "Ti2", "Mg3", "Fe3", "Ca4", "Na4", "Si1", "Al1", "Si2", "O1", "O2", "Cl3", "F3", "O-H3", "O3*", "O4", "O5", "O6", "O7"]

atoms_x:
AAAAAAAAAACAGQIAgBkCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADD2EAAw9hAAcMQRAHBXBgBwagcA8EoGAPBKBgDwSgYAMNUJAKCFFgAgNBUAcOQUAKBfFAA=

atoms_y:
gIQeAICEHgCAhB4AgIQeANBZHADQWRwAAMMFAADDBQAA8AoAAPAKAADwCgAA8AoAAAAAAAAAAABgIBEAYCARAFBBBQBQQQUA8JYKALCVBQCQ2AoAAAAAAAAAAAAAAAAAAAAAALBADwCwUQgAQHIHAAAAAAA=

atoms_z:
AAAAAAAAAACwUAQAsFAEAAAAAAAAAAAAgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAOBYEgDgWBIAkIQxALABDQDQ8ywAUNoqAFDaKgBQ2ioAEMgsADCBMAAQAwYAEHskAJArEgA=

atoms_occupancy:
AFMHAID8CgCAqQMAQH4FAICpAwBAfgUAgPwKAIAMMgDA6xIAwCAfAEBgCgBAnAAAAOIEAAAnOABAwzgAwEUEAID1IACAExwAAAk9AAAJPQAACT0AQOgdAMBFBAAA2xoAAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
OCACADggAgDonAIA6JwCABCmAwAQpgMAiJAAAIiQAAC4dAAAuHQAALh0AAC4dAAAeIwAAHiMAABIqAAASKgAAAhhAAAIYQAA4GoAACiqAABIngAAELgAABC4AAAQuAAAaPEAAAi2AAAYsAAA2McAACAHAQA=

qdat:
AAAAAAAAAAAEIAAAAAAAYBAwCAgAAACCAIEIAgIAlCgiBQkGgITFDxBCBOGAi2BYFUGjYfWAQYyx3DoAh6EM0LsZ6iYHo1FZSoHbyzLLE7zjKZqzTAle/M8hX5wsDz2jsXL0C7VKGB4uBskYJeYlG0+N2OwHIArR0CYoxp==


formula: Si6 Be2.664 Li.315 Al2 O18.72 Cs.083 Na.24 H1.476
compound: <missing>
formula_title: <missing>
a: 9.197
b: 9.197
c: 9.202
alpha: 90
beta: 90
gamma: 120
cell_volume: 674.070
crystal_density: 2.790
atoms_sites: ["Si", "Be", "Li", "Al", "O1", "O2", "OW", "Cs", "Na", "H"]
atoms_x: 8MUXAICEHgCAhB4Aq7AoABC1EgDAcR4AAAAAAAAAAAAAAAAAgJ0FAA==
atoms_y: 4DYHAAAAAAAAAAAAVVgUANBiDgDA9QgAAAAAAAAAAAAAAAAAwMgDAA==
atoms_z: AAAAAEBCDwBAQg8AQEIPAAAAAAAQ2AgAQEIPAEBCDwAAAAAAgEkTAA==
atoms_occupancy: AAk9AAAzNgCgaAYAAAk9AAAJPQAACT0AAPIrAOAQBQAApg4A4IEHAA==
atoms_u_iso: WEMAAFBBAABQQQAAaDMAAJiAAACoegAAyIsBAMiLAQDgKAEAiN0DAA==
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 refinements of beryl by single-crystal neutron and X-ray diffraction
 Sample no. 1, morganite, probed with neutrons, T = 30 K

qdat:
AAAAAAAAAAAAAQAAAAAAAABAAAIAAAAAQABACAAEAEAAAEAIDABAGAAAAIEAYKAAMCCAIOEAgQQECEBAjARQAQRgAxAgiBBECEQZxBCIIxBGQRkAJBOQxIJiEyCJCJBMhEgcCNjICRM0IoXQujZAULIkiZEsShaJImg0WR==


formula: Si6 (Be2.682 Li.318) Al2 O18.61 Cs.083 Na.24 H1.26
compound: <missing>
formula_title: <missing>
a: 9.208
b: 9.208
c: 9.197
alpha: 90
beta: 90
gamma: 120
cell_volume: 675.317
crystal_density: 2.776
atoms_sites: ["Si", "Be", "Li", "Al", "O1", "O2", "OW", "Cs", "Na", "H"]
atoms_x: kLwXAICEHgCAhB4Aq7AoAGCwEgDQax4AAAAAAAAAAAAAAAAAAGUEAA==
atoms_y: 4DYHAAAAAAAAAAAAVVgUAHBZDgDo9QgAAAAAAAAAAAAAAAAAQH4FAA==
atoms_z: AAAAAEBCDwBAQg8AQEIPAAAAAAB42QgAQEIPAEBCDwAAAAAAwGgTAA==
atoms_occupancy: AAk9AMCQNgBAeAYAAAk9AAAJPQAACT0AQDslAOAQBQAApg4AoGgGAA==
atoms_u_iso: WDkAABhbAAAYWwAAUEEAAEioAAB4jAAAWMgCAFjIAgCgnwEAkBcDAA==
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 refinements of beryl by single-crystal neutron and X-ray diffraction
 Sample no. 1, morganite, probed with neutrons, T = 295 K

qdat:
AAAAAAAAAAAAAQAAAAAAAADAAAIAAAAAQADAEAAIAEAAAEAICABAEAAAAYIAQSAAICCAYWEAgQgEGIBBCAxwAQRgBxAgiBDIEMwRiBGYZyCEwTEAZDOgjITkNSGZCZCdDNgcCbCYESJkZImRMiaAkSRli6N4nCyTRvBoki==


formula: Si6 (Be2.682 Li.318) Al2 O18.16 Cs.096 H.32
compound: <missing>
formula_title: <missing>
a: 9.208
b: 9.208
c: 9.197
alpha: 90
beta: 90
gamma: 120
cell_volume: 675.317
crystal_density: 2.717
atoms_sites: ["Si", "Be", "Li", "Al", "O1", "O2", "Wat", "Cs"]
atoms_x: gK4XAICEHgCAhB4Aq7AoAEDfEgDAcR4AAAAAAAAAAAA=
atoms_y: UBwHAAAAAAAAAAAAVVgUAMBtDgCw5wgAAAAAAAAAAAA=
atoms_z: AAAAAEBCDwBAQg8AQEIPAAAAAADg3wgAAAAAAEBCDwA=
atoms_occupancy: AAk9AMCQNgBAeAYAAAk9AAAJPQAACT0AAMQJAADcBQA=
atoms_u_iso: SD8AAMB2AADAdgAAOEUAADCsAACoegAAsMkDAJgHBgA=
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 refinements of beryl by single-crystal neutron and X-ray diffraction
 Sample no. 1, morganite, probed with X-rays, T = 295 K

qdat:
AAAAAAAAAAAAAQAAAAAAAADAAAIAAAAAQABAEAAIAEAAAEAICABAEAAAAYIAQSAAICCAYWEAgQgEGIBBCAxwAQRgBxAgiBDIEMwRiBGYZyCEwTEAZDOgjITkNSGZCZCdDNgcCbCYESJkZImRMiYAkSRli6N4mCyTRvBoki==


formula: Si6 Be3 (Al1.97 Fe.03) O18.24 Na.016 H.26
compound: <missing>
formula_title: <missing>
a: 9.218
b: 9.218
c: 9.197
alpha: 90
beta: 90
gamma: 120
cell_volume: 676.784
crystal_density: 2.664
atoms_sites: ["Si", "Be", "Al", "Fe", "O1", "O2", "Na", "OW", "H"]
atoms_x: AKIXAICEHgCrsCgAq7AoAKDoEgCQbx4AAAAAAAAAAAAAAAAA
atoms_y: 0A8HAAAAAABVWBQAVVgUADBsDgAI4AgAAAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwBAQg8AQEIPAAAAAABI3AgAQEIPAEBCDwAgEgoA
atoms_occupancy: AAk9AAAJPQCgHjwAYOoAAAAJPQAACT0AAPoAAACmDgBA7wcA
atoms_u_iso: eC0AABBZAABwNQAAcDUAAJCIAAAYWwAAiN0DAIjdAwCQFwMA
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 refinements of beryl by single-crystal neutron and X-ray diffraction
 Sample no. 2, aquamarine, probed with neutrons, T = 295 K

qdat:
AAAAAAAAAAAAAQAAAAAAAADAAAYAAAAAQACAEAAIAEAAAEAICABAEAAAAYIAQUAAICCAYeIBgxgIGIDBCBjgAgxAChBhmDDQEMwziDGwRyGMw1IATDPBjYjod2ObE7E6HbA4G7E4M+bsTYuiJmwBs2hLF0bxMEsnjaBx3O==


formula: Si6 Be3 (Al1.97 Fe.03) O18.48 H.96
compound: <missing>
formula_title: <missing>
a: 9.218
b: 9.218
c: 9.197
alpha: 90
beta: 90
gamma: 120
cell_volume: 676.784
crystal_density: 2.684
atoms_sites: ["Si", "Be", "Al", "Fe", "O1", "O2", "Wat"]
atoms_x: WKQXAICEHgCrsCgAq7AoADDqEgCgbh4AAAAAAA==
atoms_y: uA4HAAAAAABVWBQAVVgUAFBvDgDg3wgAAAAAAA==
atoms_z: AAAAAEBCDwBAQg8AQEIPAAAAAADA3AgAQEIPAA==
atoms_occupancy: AAk9AAAJPQCgHjwAYOoAAAAJPQAACT0AAEwdAA==
atoms_u_iso: gC8AABBZAACQKQAAkCkAAEieAAD4XAAACJIGAA==
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 refinements of beryl by single-crystal neutron and X-ray diffraction
 Sample no. 2, aquamarine, probed with X-rays, T = 295 K

qdat:
AAAAAAAAAAAAAQAAAAAAAADAAAYAAAAAQACAEAAIAEAAAEAICABAEAAAAYIAQUAAICCAYeIBgxgIGIDBCBjgAgxAChBhmDDQEMwziDGwRyGMw1IATDPBjYjod2ObE7E6HbA4G7E4M+bsTYuiJmwBs2hLF0bxMEsnjaBx3O==


formula: Fe4 O12.25 H12.5
compound: Broken Hill, New South Wales, Australia
pub_title: Bernalite, Fe(OH)3, a new mineral from Broken Hill, New South Wales: Description and structure
formula_title: <missing>
a: 7.544
b: 7.560
c: 7.558
alpha: 90
beta: 90
gamma: 90
cell_volume: 431.053
crystal_density: 3.328
atoms_sites: ["Fe", "O-H1", "O-H2", "O-H3", "Wat"]
atoms_x: QEIPAICEHgDg5gsAwGgTAAAAAAA=
atoms_y: QEIPAEDdCgDAmAsAgIQeAICEHgA=
atoms_z: QEIPAIDMEgCAhB4A4LYTAICEHgA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AEBCDwA=
atoms_u_iso: kEwAAKAPAACgDwAAoA8AAABkAAA=
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:
AAAAAAAAAAAAAAAAAAACAAAAAAADAAAAAAgAAAAQAAABAAAAgAABAAAMAABAAAgAAgABgADAAAABgAMABgAYAMADABAAgAwAgBwBgBgDAGAAAQBgHAMAgHAYBAMBwGAwGAgGAAMBgYHBwMHAoMABgcHDg4AGBAwYMDBAwQ==


formula: U Pb Te2 O8
compound: <missing>
pub_title: The crystal structure of moctezumite [PbUO2](TeO3)2
formula_title: <missing>
a: 7.813
b: 7.061
c: 13.775
alpha: 90
beta: 93.71
gamma: 90
cell_volume: 758.341
crystal_density: 7.256
atoms_sites: ["U", "Pb", "Te1", "Te2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8"]
atoms_x: YBADAKBvIgDAXBUA4MoxAKDTCQAAERIA4BotAGCJJQAgmh0AwAE5ACB1OAAAyDIA
atoms_y: wIsJABCTBwBwUgsA0C8KAAA/NABgSBsAoFoyAEAeFQCADDIAwBogAMAhCgCA9DUA
atoms_z: mGMxAFgWFAAgvwIA4G8jAEDpCACAMgIAIHcOAGC6CADgnwIA4HUJACAMCwBAkAIA
atoms_occupancy: 0
atoms_u_iso: eIwAAHDzAABonAAAYJoAAAgVAQAIFQEAkDwBAOAoAQAIFQEAkDwBAOAoAQDwdwEA
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:
AAAAAAAAAAAAAEAQCAAAgqAAACBQACGikLggIUAIphElkSEwsRroxi2K3FGZj8v1k9CZ2H8OfFv/6uVn3f3vb5X++/7r9/259e8q3/mf/38f/8/f9/e9/7f/vP/3//dd5Wv21eeb/3d/f//Xb/Xnt/7vy7/3tX/59/f+/3==


formula: O24 Si7.4 Ti.6 Mg5 (Na Ca) K H2
compound: <missing>
formula_title: <missing>
a: 10.0746
b: 18.0337
c: 5.2979
alpha: 90
beta: 104.906
gamma: 90
cell_volume: 930.145
crystal_density: 3.022
atoms_x: EMsGADAZBwDwfAYAwKcVAGC9FACwhhQAgCoUAOBFEQDgRREA4EURAAAAAAAAAAAAAAAAAAAAAAAAAAAAsBcBAA==
atoms_y: 4FsFAJB0CgAAAAAAoBkPAFDkBwCgFwcAAAAAACAwBQDAbAoAwGwKAJB5BQDQ9woAAAAAACDoEAAg6BAAgIQeAA==
atoms_z: UBENAFA4LABgySsAsHQwAED7BQCwwiMAcL4SAHBzEgAwYjEAMGIxAICEHgAAAAAAAAAAAICEHgCAhB4AMJsCAA==
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQBA4TMAwCcJAAAJPQAACT0AAAk9AICEHgCAhB4AgIQeAA==
atoms_u_iso: SJ4AAEieAABIngAASJ4AAKjZAACo2QAAgO0AADhPAAA4TwAAOE8AAMB2AADAdgAAwHYAACCyAAAgsgAAKMcBAA==
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:
 The OH-F substitution in Ti-rich potassium richterite: Rietveld structure
 refinement and FTIR and micro-Raman spectroscopic studies of synthetic
 amphiboles in the system K2O-Na2O-CaO-MgO-SiO2-TiO2-H2O-HF
 Sample Rich58
 Atomic parameters from ICSD

atoms_sites:
["O1", "O2", "O3", "O4", "O5", "O6", "O-H", "Si1", "Si2", "Ti", "Mg1", "Mg2", "Mg3", "Na", "Ca", "K"]

qdat:
AAAAAAAAAAACQAAAAAAAEEAUEAQAAABiBIBICACAKglkEJEgxADZQOQIkQ1AFfGIGWEsDBkwMNI2W8oEHbCctu3hoxkjNk6FahpDszNjZqBkzl4DeQM29VlaXPLKWnyasY0Yoy1RZPjASppyOwUaCyX3iSV6CUhFUmQuiU==


formula: O23.6 (F.4 Si7.44) Ti.56 Mg5 (Na Ca) K H1.6
compound: <missing>
formula_title: <missing>
a: 10.0613
b: 18.0314
c: 5.2963
alpha: 90
beta: 104.896
gamma: 90
cell_volume: 928.561
crystal_density: 3.027
atoms_x: 4OsGAMAaBwAAiwYAAIsGAKC9FQBQfRQAMKwUAAAeFADg4RAAMFoRADBaEQAAAAAAAAAAAAAAAAAAAAAAAAAAAGA1AQA=
atoms_y: 8GkFAIB/CgAAAAAAAAAAAAAjDwCA3AcAAAgHAAAAAADQNAUAAHMKAABzCgAwcAUAUOsKAAAAAAAA5RAAAOUQAICEHgA=
atoms_z: 0GgNAIAwLABA3ysAQN8rADBoMACQxAUA0PcjADADEwAwhhIA8HQxAPB0MQCAhB4AAAAAAAAAAACAhB4AgIQeAKBIAwA=
atoms_occupancy: AAk9AAAJPQAA1DAAADUMAAAJPQAACT0AAAk9AAAJPQAACT0AgH00AICLCAAACT0AAAk9AAAJPQCAhB4AgIQeAICEHgA=
atoms_u_iso: SJ4AAEieAABIngAASJ4AAEieAACo2QAAqNkAAIDtAAA4TwAAOE8AADhPAADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQA=
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:
 The OH-F substitution in Ti-rich potassium richterite: Rietveld structure
 refinement and FTIR and micro-Raman spectroscopic studies of synthetic
 amphiboles in the system K2O-Na2O-CaO-MgO-SiO2-TiO2-H2O-HF
 Sample Rich59
 Atomic parameters from ICSD

atoms_sites:
["O1", "O2", "O-H", "F", "O4", "O5", "O6", "O7", "Si1", "Si2", "Ti", "Mg1", "Mg2", "Mg3", "Na", "Ca", "K"]

qdat:
AAAAAAAAAAACQAAAAAAAEEAUEAQAAABiBIBICACAKglkCJEgwgBUwOQIiQzAFfnICSCuCgkwKFIzW8YEF7CKdbXgopkjF0uG5xUjqRPjV/AiplYDeQKVe71NTPJpT3RekUuUoytJInhgTY5SPoMPBSe+jRV2DMgjOlIehK==


formula: O23.2 (F.8 Si7.52) Ti.48 Mg5 (Na Ca) K H1.2
compound: <missing>
formula_title: <missing>
a: 10.0427
b: 18.0254
c: 5.2922
alpha: 90
beta: 104.875
gamma: 90
cell_volume: 925.909
crystal_density: 3.033
atoms_x: cO0GANDdBgBAXwYAQF8GABCjFQBwmRQAcJkUAEA9FADA9xAAMEERADBBEQAAAAAAAAAAAAAAAAAAAAAAAAAAAMCJAQA=
atoms_y: 8GkFAEBgCgAAAAAAAAAAALAODwDQ1wcAYBEHAAAAAAAQOwUAgGYKAIBmCgCghwUAEOUKAAAAAAAw3RAAMN0QAICEHgA=
atoms_z: UEMNAGBGLABQoisAUKIrAEArMAAQ0QUA0PcjAKAzEwBgMxIAcIExAHCBMQCAhB4AAAAAAAAAAACAhB4AgIQeAPARAwA=
atoms_occupancy: AAk9AAAJPQAAnyQAAGoYAAAJPQAACT0AAAk9AAAJPQAACT0AALY1AABTBwAACT0AAAk9AAAJPQCAhB4AgIQeAICEHgA=
atoms_u_iso: SJ4AAEieAABIngAASJ4AAEieAACo2QAAqNkAAIDtAAA4TwAAOE8AADhPAADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQA=
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:
 The OH-F substitution in Ti-rich potassium richterite: Rietveld structure
 refinement and FTIR and micro-Raman spectroscopic studies of synthetic
 amphiboles in the system K2O-Na2O-CaO-MgO-SiO2-TiO2-H2O-HF
 Sample Rich60
 Atomic parameters from ICSD

atoms_sites:
["O1", "O2", "O-H", "F", "O4", "O5", "O6", "O7", "Si1", "Si2", "Ti", "Mg1", "Mg2", "Mg3", "Na", "Ca", "K"]

qdat:
AAAAAAAAAAACIAAAAAAAEEAUEAQAAABiBIBIBACAGgVUCIkgwgB04NIEiQTADOnIDbCuDgyQKHEbKuYCC1COU1LwYpSjlSdCtoyh6ZOhmvgzV1cBvYFe6faqpHlZJr52WOrMUbbIkTQgRM86H0OPA5LPhpO9BMQRpSUPQm==


formula: O22.8 (F1.2 Si7.6) Ti.4 Mg5 (Na Ca) K H.8
compound: <missing>
formula_title: <missing>
a: 10.0262
b: 18.0194
c: 5.2871
alpha: 90
beta: 104.874
gamma: 90
cell_volume: 923.194
crystal_density: 3.039
atoms_x: 4NIGAJAJBwAAWQYAAFkGAKCkFQDwpRQA8KUUAOBMFABA6xAAwFsRAMBbEQAAAAAAAAAAAAAAAAAAAAAAAAAAAPCaAQA=
atoms_y: gGsFAEBgCgAAAAAAAAAAAIAWDwCQ0QcAgBQHAAAAAACAOQUAoGkKAKBpCgBAfgUAUOsKAAAAAACg2xAAoNsQAICEHgA=
atoms_z: IAANAPBHLAAwuCsAMLgrAABXMABQ1wUA4B4kAJDzEgDwTRIAYIwxAGCMMQCAhB4AAAAAAAAAAACAhB4AgIQeACCHAwA=
atoms_occupancy: AAk9AAAJPQAAahgAAJ8kAAAJPQAACT0AAAk9AAAJPQAACT0AgO42AIAaBgAACT0AAAk9AAAJPQCAhB4AgIQeAICEHgA=
atoms_u_iso: SJ4AAEieAABIngAASJ4AAEieAACo2QAAqNkAAIDtAAA4TwAAOE8AADhPAADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQA=
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:
 The OH-F substitution in Ti-rich potassium richterite: Rietveld structure
 refinement and FTIR and micro-Raman spectroscopic studies of synthetic
 amphiboles in the system K2O-Na2O-CaO-MgO-SiO2-TiO2-H2O-HF
 Sample Rich61
 Atomic parameters from ICSD

atoms_sites:
["O1", "O2", "O-H", "F", "O4", "O5", "O6", "O7", "Si1", "Si2", "Ti", "Mg1", "Mg2", "Mg3", "Na", "Ca", "K"]

qdat:
AAAAAAAAAAACIAAAAAAAECAUEAQAAABiAoBIBACAGgS0BIkQ4QBsoHIEhYTACvlkBbBvBgyYFDiZlqMBC9hGUTvwckzRjZOhW0ZRdMnxXtgZq6uA1sEvdP3VUly8Yzc7LHXlULzUiJooJqcVDsCHgcVHwslmhWERcqSHoT==


formula: O22.4 (F1.6 Si7.76) Ti.24 Mg5 (Na Ca) K H.4
compound: <missing>
formula_title: <missing>
a: 10.0166
b: 18.0189
c: 5.2871
alpha: 90
beta: 104.908
gamma: 90
cell_volume: 922.138
crystal_density: 3.034
atoms_x: AL0GAAAhBwCQQQYAkEEGADC/FQCQgxQAkIMUAMBiFADA3hAAcC4RAHAuEQAAAAAAAAAAAAAAAAAAAAAAAAAAAKCGAQA=
atoms_y: YGgFAJBbCgAAAAAAAAAAAGATDwDg5QcA4B0HAAAAAADgKQUAgGYKAIBmCgDwggUAQPYKAAAAAADQ0xAA0NMQAICEHgA=
atoms_z: IDINAAA9LADAuSsAwLkrAFBrMABAyQUAEP4jAMCBEwAQOBIAYHMxAGBzMQCAhB4AAAAAAAAAAACAhB4AgIQeAACEAwA=
atoms_occupancy: AAk9AAAJPQAANQwAANQwAAAJPQAACT0AAAk9AAAJPQAACT0AgF85AICpAwAACT0AAAk9AAAJPQCAhB4AgIQeAICEHgA=
atoms_u_iso: SJ4AAEieAABIngAASJ4AAEieAACo2QAAqNkAAIDtAAA4TwAAOE8AADhPAADAdgAAwHYAAMB2AAAgsgAAILIAACjHAQA=
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:
 The OH-F substitution in Ti-rich potassium richterite: Rietveld structure
 refinement and FTIR and micro-Raman spectroscopic studies of synthetic
 amphiboles in the system K2O-Na2O-CaO-MgO-SiO2-TiO2-H2O-HF
 Sample Rich62
 Atomic parameters from ICSD

qdat:
AAAAAAAAAAACIAAAAAAAECAUEAQAAABhAoBIBACAGgSsBIkQoQBssHIERIRgCvlkBqhvAgzYFDiIlrMBBdhHSSm4MixQz8qRW0VI9Km5TmwVdqmAUqCdNlt0qyxsUbsblmzVKGzWyF4kElMOheCHQMXF4cVig2CE8pJDoT==


formula: O22 F2 Si7.84 Ti.16 Mg5 (Na Ca) K
compound: <missing>
formula_title: <missing>
a: 10.0149
b: 18.0099
c: 5.2862
alpha: 90
beta: 104.954
gamma: 90
cell_volume: 921.167
crystal_density: 3.034
atoms_sites: ["O1", "O2", "F", "O3", "O4", "O5", "O6", "Si1", "Si2", "Ti", "Mg1", "Mg2", "Mg3", "Na", "Ca", "K"]
atoms_x: 0N0GAJDwBgAQHAYA4KoVAPCMFADwjBQAkFEUALACEQAASREAAEkRAAAAAAAAAAAAAAAAAAAAAAAAAAAAEGwBAA==
atoms_y: IGIFANBhCgAAAAAAICYPAHDnBwBwHwcAAAAAAEAzBQBgYwoAYGMKAEB+BQBA9goAAAAAAFDgEABQ4BAAgIQeAA==
atoms_z: MHINAOA5LAAQzisA0F4wAICdBQAgPiQA0CsTAMCHEgAgOzEAIDsxAICEHgAAAAAAAAAAAICEHgCAhB4AYCkDAA==
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAAmDoAAHECAAAJPQAACT0AAAk9AICEHgCAhB4AgIQeAA==
atoms_u_iso: SJ4AAEieAABIngAASJ4AAKjZAACo2QAAgO0AADhPAAA4TwAAOE8AAMB2AADAdgAAwHYAACCyAAAgsgAAKMcBAA==
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:
 The OH-F substitution in Ti-rich potassium richterite: Rietveld structure
 refinement and FTIR and micro-Raman spectroscopic studies of synthetic
 amphiboles in the system K2O-Na2O-CaO-MgO-SiO2-TiO2-H2O-HF
 Sample Rich63
 Atomic parameters from ICSD

qdat:
AAAAAAAAAAACIAAAAAAAECAMEAQAAAAhAkBIBACAGgSqBIkQoQBqsHECRIRgCnjkAphnAgbYEjiM1bMBBWhDKam4KSxQxsqRLaMo8q14pywc9tWAU6BVulnsqSxsMZsNlVr2qC5LyC4UCymOhtDDoONi4ONyQdCEaUlCkK==


formula: Ca1.67 Mn.33 Si O5 H2
compound: <missing>
formula_title: <missing>
a: 9.398
b: 9.139
c: 10.535
alpha: 90
beta: 90
gamma: 90
cell_volume: 904.833
crystal_density: 2.865
atoms_sites: ["Ca1", "Ca2", "Mn", "Si", "O-h1", "O2", "O3", "O-h4", "O5", "H1", "H2"]
atoms_x: MGcJAFBKHwBQSh8ACCAUAGBeDwCQlvz/wDkGAFAzGACwUgwAoK8PAIDf+v8=
atoms_y: MBseADBhFAAwYRQAuCENAOBfFQBg6RUAUFcrAECFIQAgVBgAQIQEAIDjIwA=
atoms_z: CNEXAEBGGgBARhoA+D4oAPAAIwAAqRoAUEQRAMBKGADQjQsAICQHACCPCgA=
atoms_occupancy: AAk9AMDkKABAJBQAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAwNQBAMDUAQA=
atoms_aniso_label: ["Ca1", "Ca2", "Mn", "Si", "O-h1", "O2", "O3", "O-h4", "O5"]
atoms_aniso_u11: oIwAANCdAADQnQAAwHYAAIC1AQDAjwAAAPoAAGC4AAAg5AAA
atoms_aniso_u22: 0J0AAICiAACAogAAMHUAAICiAACQ4gAAYNEAAOAoAQCQ4gAA
atoms_aniso_u33: QIMAACCZAAAgmQAA0GsAAMDaAADQtgAA8IcAAAD6AACQyQAA
atoms_aniso_u12: wPn//6Dd//+g3f//IAMAAOBHAABQ4v//YCIAAEDt///ARAAA
atoms_aniso_u13: 8AoAAFD7//9Q+///4Pz//8B8///g/P//UEYAAOD8//8gHAAA
atoms_aniso_u23: sAQAAMD5///A+f//wPn//zD4//9gvv//MEMAAHBiAAAA5///
pub_title:
 Poldervaartite, Ca(Ca0.5Mn0.5)(SiO3OH)(OH), a new acid nesosilicate from the
 Kalahari manganese field, South Africa: Crystal structure and description

qdat:
AAAAAAAAAAAAAAAAAABBAAJAAkAoABIAoFAACGByE6RCEVxwRg6wwTDDNSIybnIH3ER3OuOc/019mr+kf//P9va+u9f7/7/927/6/d/9/f///+7v//9///f////9//Nd9/79/v9b7/f+2fs/e/94da1j6/C61tiBwiq0ul==


formula: Ba Sr2 Mn2 Si4 O14
compound: <missing>
formula_title: <missing>
a: 14.600
b: 7.759
c: 5.142
alpha: 90
beta: 93.25
gamma: 90
cell_volume: 581.556
crystal_density: 4.333
atoms_sites: ["Ba", "Sr", "Mn1", "Mn2", "Si1", "Si2", "O1", "O2", "O3", "O4", "O5", "O6", "O7"]
atoms_x: AAAAAFB7DAAAAAAAAAAAAFD9BwCAZ/X/YBT6/4D99f8AJPr/4JkDACAMCwDAyAMAAGbv/w==
atoms_y: oIkNANCu+f+gOfn/YGLt/4Dg5f9A1wsA4Bfv/2BaGACAIAUAQE/4/2CoCwAAvR8A4HsIAA==
atoms_z: AAAAAJDu/v+AhB4AAAAAAMAp3/9guR0AYGnX/6B82f/AVhYAQFoLAMCSDACAbQ0AIErX/w==
atoms_occupancy: 0
atoms_u_iso: gI4AAPhmAAAQWQAA6GIAAOhiAADoYgAA+MUAAPjFAABIngAAOE8AAMB2AAAgsgAAOE8AAA==
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:
 Taikanite, BaSr2Mn2O2[Si4O12], from the Wessels mine, South Africa: A chain
 silicate related to synthetic Ca3Mn2O2[Si4O12]

qdat:
AAAAAAAAAAAAAAIIAAAAIAAAAHAgCAEAAJAAQQIEBQAQoRQACwDSgAwDAnUBAwwGEgjLEyRhKA4BNVBPEkceSgqTzBXC0lPBFhQeqtotAG81rlJiArM1a4MXICJd+Yes2W7XkGLuOa8uJmvEu8zJdzBVrRnqRiGwfZAZ+f==


formula: Tl3 As S4
compound: <missing>
formula_title: <missing>
a: 8.894
b: 10.855
c: 9.079
alpha: 90
beta: 90
gamma: 90
cell_volume: 876.526
crystal_density: 6.186
atoms_sites: ["Tl1", "Tl2", "As", "S1", "S2", "S3"]
atoms_x: QLwDAFBrFwDwIREAQK0SAIA+AADQgAkA
atoms_y: 4AMDAEBCDwBAQg8AQEIPAEBCDwDQTQUA
atoms_z: YPMLAKBS+f+A9BwAIEUOAIDiOACgrSAA
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Tl1", "Tl2", "As", "S1", "S2", "S3"]
atoms_aniso_u11: MAUCABCFAQBg6gAAIEgBAIA4AQCAtQEA
atoms_aniso_u22: wHABAADoAwCAOAEAoAMCAAD0AQAAdwEA
atoms_aniso_u33: oOoBAIC1AQDA2gAAwF0AAAB3AQDgIgIA
atoms_aniso_u12: 0CAAAAAAAAAAAAAAAAAAAAAAAAAAg///
atoms_aniso_u13: MPj//0AfAAAAAAAAYPD//yBOAABAHwAA
atoms_aniso_u23: QNT//wAAAAAAAAAAAAAAAAAAAADAXQAA
pub_title:
 Fangite, Tl3AsS4, a new thallium arsenic sulfosalt from the Mercur Au deposit,
 Utah, and revised optical data for gillulyite

qdat:
AAAAAAAAAAAAAAAgEAAYAAAkANQCgAkQMoIAkZdgAJwpAweSkGr5WeBLE5Vb1cu91SyLP27/9d//ZzfX2u+77+/P/9//99/+//X/v9/+/9//9v9///9///+////X+//7//6/ff//b/7/fv2ev/7d+7f36dkD398zqPRs1R==


formula: Al2.25 Si.75 O4.871
compound: <missing>
pub_title: Crystal structure and compressibility of 3:2 mullite
formula_title: <missing>
a: 7.54336
b: 7.69176
c: 2.88402
alpha: 90
beta: 90
gamma: 90
cell_volume: 167.336
crystal_density: 3.170
atoms_sites: ["Al", "Al1", "Si1", "Al2", "Si2", "O1", "O2", "O3", "O4"]
atoms_x: AAAAAFAQCQBQEAkAIO4PACDuDwAQ1RUAgIQeADBKHACQuAcA
atoms_y: AAAAAHDLFABwyxQAEKcMABCnDAAw2RkAAAAAAJDWAgDQaA0A
atoms_z: AAAAAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAICEHgAAAAAA
atoms_occupancy: AAk9ACALIADA3xQAgBoGAKADAgAACT0A4P0cAMAVDAAACT0A
atoms_u_iso: eC0AAIAvAACALwAAABJ6AAASegCIowEAqJcBAGiAAwCAqwEA
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:
AAAAAAAAAAAAAAAAAAAEAAAAAAARAAEgAAAAIABAAQARAKAGAJAAAQEEZQIAAbAAAEIiGkCSCEEQAHpFECpoNBID4IFLFSBoIQTPVIApyaoVEpetNVpCT7aCiJ6/YqFlnVJmipco5ZJtxtcWS0/tUQbGDeu3f9ljFrBrn5==


formula: Mg4.95 Al1.7 Fe.33 Si3.02 O18 H8
compound: <missing>
formula_title: <missing>
a: 5.3437
b: 9.256
c: 14.422
alpha: 90.25
beta: 97.28
gamma: 89.99
cell_volume: 707.573
crystal_density: 2.654
atoms_u_iso: 0
pub_title:
 Inferred limitations to the oxidation of Fe in chlorite: a high-temperature
 single-crystal X-ray study
 T = 550 C

atoms_sites:
["Mg1", "Al1", "Mg2", "Al2", "Mg3", "Al3", "Al4", "Fe4", "SiT1", "AlT1", "SiT2", "AlT2", "O-h1", "O-h2", "O-h3", "O-h4", "O1", "O2", "O3", "O4", "O5", "H1", "H2", "H3", "H4"]

atoms_x:
AAAAAAAAAADwCgAA8AoAAIDz//+A8///AAAAAAAAAADAIg4AwCIOALClLACwpSwAsDQqALAACQBQkwgAsBQnAFDlCwCgWCoAQIANAPD/HgBgnwAAACkOAGAxCgDgBAcAAJklAA==

atoms_y:
AAAAAAAAAAAQXhQAEF4UAGAxCgBgMQoAgIQeAICEHgDgPQoA4D0KADARAAAwEQAAQFYUABD1//8gbBQA4PIJAPAyCgBABgAAUEsUAEDJBQAwdgQAAMIzAKChOwCgnRIAIBgJAA==

atoms_z:
AAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AgIQeAICEHgCgrgsAoK4LAKCuCwCgrgsA8G8EAIA4GgDwNhoAwD4aAEC2BADgrAQA0DAOALAtDgCgOA4AwKoIAAD5FQBgZhYAIEcWAA==

atoms_occupancy:
wGw8AECcAADAbDwAQJwAAMBsPABAnAAAwOQoAEAkFADgFC4AIPQOAOAULgAg9A4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_aniso_label:
["Mg1", "Al1", "Mg2", "Al2", "Mg3", "Al3", "Al4", "Fe4", "SiT1", "AlT1", "SiT2", "AlT2", "O-h1", "O-h2", "O-h3", "O-h4", "O1", "O2", "O3", "O4", "O5"]

atoms_aniso_u11:
IE4AACBOAAAgTgAAIE4AACBOAAAgTgAA4KUBAOClAQCAPgAAgD4AAMBdAADAXQAAgD4AAAB3AQDA1AEA4CgBAOAuAADAXQAAgLUBAIC7AABgZwEA

atoms_aniso_u22:
wF0AAMBdAACAPgAAgD4AAGBtAABgbQAA4CICAOAiAgBgbQAAYG0AAECcAABAnAAAgLsAACBIAQAgSAEAgDgBAKCMAACgjAAA4CgBAAD0AQBAlgEA

atoms_aniso_u33:
gLUBAIC1AQAgxQEAIMUBAIC1AQCAtQEAYN4CAGDeAgAAdwEAAHcBAIC1AQCAtQEAAPQBAAD0AQDAVwEAoAMCAOClAQDA1AEAoIACAOCfAgAA9AEA

atoms_aniso_u12:
IE4AACBOAACAPgAAgD4AAOAuAADgLgAAQB8AAEAfAADgLgAA4C4AAMBdAADAXQAAgD4AAGDw//9AHwAAQJwAAIA+AADAXQAAQB8AACDLAABAov//

atoms_aniso_u13:
4C4AAOAuAACAPgAAgD4AAIA+AACAPgAAIE4AACBOAADgLgAA4C4AAIA+AACAPgAAgD4AAKAPAAAAAAAAwF0AAEAfAADAXQAAAH0AACBOAAAgTgAA

atoms_aniso_u23:
YPD//2Dw//8AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABg8P//YPD//wAAAAAAAAAAAAAAAAAAAADA4P//YPD//6APAACgDwAAoA8AAKAPAAAAAAAA

qdat:
AAAAAAAIAAAIAECAAAEBAAjBCAggEIgOAIlACoKsEwDTA9IiAssSuIgeVwNK7Wb3TTHlcuqer07DGuW9vv582a5+t9f63VvxnZ3t3b8rd/uc67Z/1fdp6nf7XvJ9+P3vvu6+1XnrzD79bIvWlt2t13d96r82X++f/jbK/9==


formula: Si2 Al3.15 Mg1.85 Na.85 O12 H2
compound: <missing>
pub_title: The crystal structure of preiswerkite Sample: KP9
formula_title: <missing>
a: 5.225
b: 9.050
c: 9.791
alpha: 90
beta: 100.27
gamma: 90
cell_volume: 455.562
crystal_density: 2.914
atoms_sites: ["SiT", "AlT", "Mg1", "Al1", "Mg2", "Al2", "Na", "O1", "O2", "O3", "O-h4", "H"]
atoms_x: UNgiAFDYIgAAAAAAAAAAAAAAAAAAAAAAAAAAACApNADwYhsAUFwmAPAlCABQkgQA
atoms_y: ICsKACArCgCAhB4AgIQeALCaMgCwmjIAAAAAALAHDAAAAAAA0EgKAAAAAAAAAAAA
atoms_z: 4PkMAOD5DACAhB4AgIQeAICEHgCAhB4AAAAAABC5CQDgwAkA4OkXACA7GAAgkRIA
atoms_occupancy: gIQeAICEHgBA4TMAwCcJAICEHgCAhB4AQOEzAAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegD4xQAA
atoms_aniso_label: ["SiT", "AlT", "Mg1", "Al1", "Mg2", "Al2", "Na", "O1", "O2", "O3", "O-h4"]
atoms_aniso_u11: GEcAABhHAAAIQwAACEMAAKh/AACofwAA6N8AAFiOAACgPAAAMOgAAFD/AAA=
atoms_aniso_u22: wGcAAMBnAACojgAAqI4AAMBnAADAZwAAWBABAEg6AADYQAAAoJsAAMDFAQA=
atoms_aniso_u33: 0GYAANBmAADAtwAAwLcAANh8AADYfAAAKOsAABi/AAAo6wAA2HwAAOioAAA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADgsAAAAAAAAGAsAAAAAAAA=
atoms_aniso_u13: oA8AAKAPAACYFwAAmBcAANAHAADQBwAA2DYAAPAyAABYUgAAeOz//wgvAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADjr//8AAAAAKDcAAAAAAAA=
qdat:
AAAAAAAAAABAAAAAAAAAACAUAEAIAAABCAIAAAAAyACkgAJEAOAQEAqAGAAgAbUlCwIBCYUYDkAQSoAGkFRkaQpwwsggU2hZgDU6EWM1gi4q25gY94HOwWUJ1iabbhNjlszY3wrEjYtFkkvQZPSpd7IE4fU2tRLiQbXBkY==


formula: Si2 Al3.15 Mg1.85 Na.85 O12 H2
compound: <missing>
pub_title: The crystal structure of preiswerkite Sample: KP17
formula_title: <missing>
a: 5.228
b: 9.049
c: 9.819
alpha: 90
beta: 100.41
gamma: 90
cell_volume: 456.873
crystal_density: 2.905
atoms_sites: ["SiT", "AlT", "Mg1", "Al1", "Mg2", "Al2", "Na", "O1", "O2", "O3", "O-h4", "H"]
atoms_x: wAgjAMAIIwAAAAAAAAAAAAAAAAAAAAAAAAAAAHA9NAAgphsAwL4mAECkBwBwEgUA
atoms_y: gDQKAIA0CgCAhB4AgIQeAOCrMgDgqzIAAAAAANAjDAAAAAAA8GQKAAAAAAAAAAAA
atoms_z: MA4NADAODQCAhB4AgIQeAICEHgCAhB4AAAAAAACrCQCwEwoAkNUXANBYGABgARIA
atoms_occupancy: gIQeAICEHgBA4TMAwCcJAICEHgCAhB4AQOEzAAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegD4xQAA
atoms_aniso_label: ["SiT", "AlT", "Mg1", "Al1", "Mg2", "Al2", "Na", "O1", "O2", "O3", "O-h4"]
atoms_aniso_u11: 6GwAAOhsAADAUwAAwFMAAIBmAACAZgAAqI0BALjEAACw2wAAuMQAAJiUAAA=
atoms_aniso_u22: KG4AAChuAABARwAAQEcAAMBnAADAZwAA6IQBAEjpAACgmwAAoJsAACDZAQA=
atoms_aniso_u33: 4CQAAOAkAAC4MwAAuDMAADgsAAA4LAAAwEkAABA7AAC4MwAAuDMAAIgdAAA=
atoms_aniso_u12: qPj//6j4//8AAAAAAAAAAAAAAAAAAAAAAAAAAFgHAAAAAAAA6PT//wAAAAA=
atoms_aniso_u13: uAsAALgLAADIDwAAyA8AAMgPAADIDwAAgBsAAEgrAADIDwAAGPz//xj8//8=
atoms_aniso_u23: IPn//yD5//8AAAAAAAAAAAAAAAAAAAAAAAAAACD5//8AAAAAyBQAAAAAAAA=
qdat:
AAAAAAAAAABAAAAAAAAAACAUAEAIAAACEAIAAAABSACogAJEAWAQEAyAEAAgAbYlCgIBCsUYHkARDwANEFzESIrQw1Ags6RRgCZqIWd5Bi4s0xhY54GNwXYr1ke/ahNDlMz42w1Ej49PFEvwOOTJ26oE4Ps2pQqiQb1BkQ==


formula: Na.25 Al6.891 Fe1.599 Mn.24 Mg.051 Li.219 Si6 B3 (O31 H4)
compound: likely White Queen mine, San Diego County, California, USA
formula_title: <missing>
a: 15.967
b: 15.967
c: 7.126
alpha: 90
beta: 90
gamma: 120
cell_volume: 1573.342
crystal_density: 3.160
atoms_x: AAAAAFjMAwBYzAMAWMwDAFjMAwBYzAMAGPYPABj2DwDglgsASE82AAAAAACAPDkA+DEIABhRNwDgxAUAUHcLAOh0EQBQkBAA
atoms_y: AAAAAKg8OQCoPDkAqDw5AKg8OQCoPDkAeDQSAHg0EgDotgsAuLkGAAAAAACAzAMACNc0AOi3BQAgRDcAmBoMAABnEQDo2AwA
atoms_z: gFEzANBfGwDQXxsA0F8bANBfGwDQXxsAcDccAHA3HACgdAQAkLMlALDjEQBQuSMAkHoiAKBaAABQ6P7/kCsSAOCY//9wkSYA
atoms_occupancy: QEIPACBTFACgVR4AAOIEAKAJAQCgdAQAwO87AEAZAQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_u11: oLgBAMBdAADAXQAAwF0AAMBdAADAXQAA0GsAANBrAADgRwAAgIkAAACjAgBw2QEAgKIAAMB2AACgcwAA0IQAAIBXAADQtgAA
atoms_aniso_u22: oLgBAMBdAADAXQAAwF0AAMBdAADAXQAAUF8AAFBfAABwSQAAgIkAAACjAgBw2QEAgKIAAMB2AACgcwAAwHYAAABkAAAQcgAA
atoms_aniso_u33: UHIBAKC+AACgvgAAoL4AAKC+AACgvgAAgFcAAIBXAACAVwAAEHIAADB1AAAQvQAAoFoAANCEAABwewAAIE4AAOB5AABQkQAA
atoms_aniso_u12: UNwAANAgAADQIAAA0CAAANAgAADQIAAAkDMAAJAzAADQIAAAYDsAAIBRAQBQiwEAIAMAAIAMAADg/P//gCUAAOAVAACgWgAA
atoms_aniso_u13: AAAAANAHAADQBwAA0AcAANAHAADQBwAAMPj//zD4//+wBAAA4Pz//wAAAACQAQAA8AoAADD4///w8f//YAkAAJAaAAAg0f//
atoms_aniso_u23: AAAAADD4//8w+P//MPj//zD4//8w+P//UPv//1D7//8gAwAAIAMAAAAAAABw/v//EPX//9AHAAAQDgAAUPv//0AGAACA8///
pub_title:
 Foitite, _[Fe2(Al,Fe)]Al6Si6O18(BO3)3(OH)4, a new alkali-deficient
 tourmaline: Description and crystal structure

atoms_sites:
["NaX", "AlY", "FeY", "MnY", "MgY", "LiY", "AlZ", "FeZ", "SiT", "B", "O-H1", "O2", "O-H3", "O4", "O5", "O6", "O7", "O8"]

atoms_aniso_label:
["NaX", "AlY", "FeY", "MnY", "MgY", "LiY", "AlZ", "FeZ", "SiT", "B", "O-H1", "O2", "O-H3", "O4", "O5", "O6", "O7", "O8"]

qdat:
AAAAAAAAAAAAAQAAEAAAAQCABAQAAAIgAiCEQAAISASAyEgIoCAJEACgUSAoSg4KDC4OXIgQYnGgwwq1cVaKOKiEeYW1w46xWDF+gRDyvsfwqb4V2BeLUB24eVRURGwqorIUTiRISR6ZECMCSIEbJMiiJJkiRBskEiSBBY==


formula: Pb1.818 Mg.98 Fe16.2 O27
compound: <missing>
pub_title: Lindqvistite, Pb2MeFe16O27, a novel hexagonal ferrite mineral from Jakobsberg, Filipstad, Sweden
formula_title: <missing>
a: 5.952
b: 5.952
c: 33.379
alpha: 90
beta: 90
gamma: 120
cell_volume: 1024.070
crystal_density: 5.634
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
atoms_sites:
["Pb1", "Pb2", "Mg2", "Fe1", "Fe2", "Mg2", "Fe3", "Fe4", "Mg4", "Fe5", "Fe6", "Mg6", "O1", "O2", "O3", "O4", "O5", "O6", "O7"]

atoms_x:
8Bz9/1BDJgBQQyYAAAAAAFVYFABVWBQAVVgUAED39f9A9/X/VVgUAICEHgCAhB4AIEX1/1VYFABQOx8AAAAAAJAQCgBVWBQAYDwdAA==

atoms_y:
4Dn6/6B9DwCgfQ8AAAAAAKuwKACrsCgAq7AoAIDu6/+A7uv/q7AoAAAAAAAAAAAAQIrq/6uwKACgbQEAAAAAACAhFACrsCgAwHg6AA==

atoms_z:
QEIPAEBCDwBAQg8AMGMDAID55f+A+eX/gJ0FAFAQCQBQEAkAMHgMAAAAAAAAAAAA8DACAJAOAgAQsgYAIPIGAPDhCgDQTez/QEIPAA==

atoms_occupancy:
IFMUAKCpEACAqQMAAAk9AIDuNgCAGgYAAAk9AMD7OQBADQMAAAk9AIDuNgCAGgYAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
cD0CAODdAADg3QAA0FIAACBOAAAgTgAAUEYAALBoAACwaAAA4A8BAPBuAADwbgAAYIYAAMBdAADgeQAA0IQAAHBiAADAqAAAMAwFAA==

qdat:
AAAAAAIAAAAAEAAAAABAMIIBASACABAIIABSAIABDSEUBAQRAEAIADUQgggICqQhBAgQEAKEBdKiEoECAdSIQggQHlEQg8oiEIQAAHpJCOIW2SYQgdSRCIAAABtP01R1JIiAAbUkRAAABI+1IkGqSRAAAPUkkAD1Sav6sk==


formula: Si Mg2 O4
compound: <missing>
formula_title: <missing>
a: 8.0709
b: 8.0709
c: 8.0709
alpha: 90
beta: 90
gamma: 90
cell_volume: 525.734
crystal_density: 3.555
atoms_sites: ["Si", "Mg", "O"]
atoms_x: IKEHAICEHgAQ5g4A
atoms_y: IKEHAICEHgAQ5g4A
atoms_z: IKEHAICEHgAQ5g4A
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Mg", "O"]
atoms_aniso_u11: qGYAAKCHAACQZQAA
atoms_aniso_u22: qGYAAKCHAACQZQAA
atoms_aniso_u33: qGYAAKCHAACQZQAA
atoms_aniso_u12: AAAAALj3///4/f//
atoms_aniso_u13: AAAAALj3///4/f//
atoms_aniso_u23: AAAAALj3///4/f//
pub_title:
 Crystal chemistry of ferromagnesian silicate spinels: Evidence for Mg-Si
 disorder
 Sample: SUNY 859

qdat:
AAAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAACAAAAAAgAAAAAAABAAAAEAAAAAAEAAAEAAAAAIAABAAAAAgAAQAAABAACAAAAgACAAABAAQAAAQAIAAAgAQAACABAAAQAQAAIAQAAAAQAAQBAACAEAAIAgACAIAAgCAAAC==


formula: Si (Mg.766 Fe1.234) O4
compound: <missing>
formula_title: <missing>
a: 8.1763
b: 8.1763
c: 8.1763
alpha: 90
beta: 90
gamma: 90
cell_volume: 546.601
crystal_density: 4.365
atoms_sites: ["Si", "Mg", "Fe", "O"]
atoms_x: IKEHAICEHgCAhB4AQMUOAA==
atoms_y: IKEHAICEHgCAhB4AQMUOAA==
atoms_z: IKEHAICEHgCAhB4AQMUOAA==
atoms_occupancy: AAk9AGBgFwCgqCUAAAk9AA==
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Mg", "Fe", "O"]
atoms_aniso_u11: QEwAAJBlAACQZQAAMHAAAA==
atoms_aniso_u22: QEwAAJBlAACQZQAAMHAAAA==
atoms_aniso_u33: QEwAAJBlAACQZQAAMHAAAA==
atoms_aniso_u12: AAAAADACAAAwAgAAeAAAAA==
atoms_aniso_u13: AAAAADACAAAwAgAAeAAAAA==
atoms_aniso_u23: AAAAADACAAAwAgAAeAAAAA==
pub_title:
 Crystal chemistry of ferromagnesian silicate spinels: Evidence for Mg-Si
 disorder
 Sample: SUNY 1013

qdat:
AAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAQAAAAAEAAAAAAAAQAAABAAAAAABAAAEAAAAAEAABAAAAAgAAgAAACAAEAAABAAIAAAEABAAACAAgAAEACAAAQAQAAEAIAACAEAAAAIAAIAgAAgCAAIAgACAIAAgEAAAEAA==


formula: Si (Mg.42 Fe1.58) O4
compound: <missing>
formula_title: <missing>
a: 8.2030
b: 8.2030
c: 8.2030
alpha: 90
beta: 90
gamma: 90
cell_volume: 551.973
crystal_density: 4.585
atoms_sites: ["Si", "Mg", "Fe", "O"]
atoms_x: IKEHAICEHgCAhB4AcL0OAA==
atoms_y: IKEHAICEHgCAhB4AcL0OAA==
atoms_z: IKEHAICEHgCAhB4AcL0OAA==
atoms_occupancy: AAk9AEDRDADANzAAAAk9AA==
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Mg", "Fe", "O"]
atoms_aniso_u11: SE4AAPBfAADwXwAAQG8AAA==
atoms_aniso_u22: SE4AAPBfAADwXwAAQG8AAA==
atoms_aniso_u33: SE4AAPBfAADwXwAAQG8AAA==
atoms_aniso_u12: AAAAAHgAAAB4AAAAQPz//w==
atoms_aniso_u13: AAAAAHgAAAB4AAAAQPz//w==
atoms_aniso_u23: AAAAAHgAAAB4AAAAQPz//w==
pub_title:
 Crystal chemistry of ferromagnesian silicate spinels: Evidence for Mg-Si
 disorder
 Sample: SUNY 1097

qdat:
AAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAQAAAAAIAAAAAAAAgAAACAAAAAAEAAAIAAAAAQAAEAAAACAACAAAAEAAQAAAEAAgAAAQAEAAAIAEAAAQAIAACABAAAgAgAAQAgAAABAABAEAAIAQABAEAAIBAAEAgAAAgAE==


formula: Si (Mg.436 Fe1.564) O4
compound: <missing>
formula_title: <missing>
a: 8.2059
b: 8.2059
c: 8.2059
alpha: 90
beta: 90
gamma: 90
cell_volume: 552.559
crystal_density: 4.568
atoms_sites: ["Si", "Mg", "Fe", "O"]
atoms_x: IKEHAICEHgCAhB4AIMIOAA==
atoms_y: IKEHAICEHgCAhB4AIMIOAA==
atoms_z: IKEHAICEHgCAhB4AIMIOAA==
atoms_occupancy: AAk9AEBODQDAui8AAAk9AA==
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Mg", "Fe", "O"]
atoms_aniso_u11: wFMAAPBuAADwbgAA+HAAAA==
atoms_aniso_u22: wFMAAPBuAADwbgAA+HAAAA==
atoms_aniso_u33: wFMAAPBuAADwbgAA+HAAAA==
atoms_aniso_u12: AAAAABgBAAAYAQAAsBMAAA==
atoms_aniso_u13: AAAAABgBAAAYAQAAsBMAAA==
atoms_aniso_u23: AAAAABgBAAAYAQAAsBMAAA==
pub_title:
 Crystal chemistry of ferromagnesian silicate spinels: Evidence for Mg-Si
 disorder
 Sample: SUNY 1102

qdat:
AAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAQAAAAAIAAAAAAAAgAAACAAAAAAEAAAIAAAAAQAAEAAAACAACAAAAIAAQAAAEAAgAAAgAEAAAIAEAAAQAIAACACAAAgAgAAQAgAAABAABAEAAIAQABAEAAQCAAIBAAABAAI==


formula: (Mg.56 Fe.44) Si O3
compound: <missing>
pub_title: Effects of pressure on Mg-Fe ordering in orthopyroxene synthesized at 11.3 GPa and 1600 C
formula_title: <missing>
a: 18.312
b: 8.917
c: 5.217
alpha: 90
beta: 90
gamma: 90
cell_volume: 851.874
crystal_density: 3.564
atoms_sites: ["Mg1", "Fe1", "Fe2", "Mg2", "SiA", "SiB", "O1A", "O2A", "O3A", "O1B", "O2B", "O3B"]
atoms_x: sO0WALDtFgCYDxcAmA8XAHiVEADQ6hwA4DcLAPD8EgCYeBIA2FAiADB0GgAAThsA
atoms_y: 6O8nAOjvJwDgiR0A4IkdAGDHFAAAhxQACKwUADiBHgBYDQ4AyJYUAHCLHQD4RgwA
atoms_z: mEE1AJhBNQAYWRYAGFkWAGAkAwBoezAAuIYCACg5AwAoR/X/iH4wAGhtKgCoPSQA
atoms_occupancy: APIrAAAXEQAAnyQAAGoYAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Fe2", "Mg2", "SiA", "SiB", "O1A", "O2A", "O3A", "O1B", "O2B", "O3B"]
atoms_aniso_u11: qIQAAKiEAACIpAAAiKQAAOhsAADobAAA6GwAAMi5AACohAAA6GwAAOiZAACgjAAA
atoms_aniso_u22: sHwAALB8AAD4ogAA+KIAAOh2AABobwAAwLcAAPidAADQ6AAAALkAAACvAACAsQAA
atoms_aniso_u33: YGMAAGBjAABgbQAAYG0AAIheAADAWAAAmIAAADB/AAAgdgAAYIsAAGCVAADQfwAA
atoms_aniso_u12: 6AMAAOgDAAAg7///IO///wjz//8oBQAAwP7//7jo///Y+v//8Pb//1AKAADA/v//
atoms_aniso_u13: mPT//5j0///w3f//8N3//5ABAABw/v//iAQAABAJAABw/v//cP7//5j0///gBgAA
atoms_aniso_u23: yAAAAMgAAADIAAAAyAAAABAEAADAAwAAeAUAANAMAAAov///gBYAAPglAADw4v//
qdat:
AAAAAAAAAAAEAAAAIAAAAABEgDQABABEDgIIJgEAUmwKgSdzIeGtZTSQ2zcBlfp2b/bS8J/JkX6IvyKxu/zv9Z6bZuXKb26N6qX7569uWz/3T237xa/9710b///37r7er97397+r63Ofqfv3c7/Hf3Zc7fmuXcxnP17W3d==


formula: Si O2
compound: <missing>
pub_title: The pressure behavior of alpha cristobalite P = room pressure
formula_title: <missing>
a: 4.9717
b: 4.9717
c: 6.9223
alpha: 90
beta: 90
gamma: 90
cell_volume: 171.104
crystal_density: 2.332
atoms_sites: ["Si", "O"]
atoms_x: 4FMSAICZDgA=
atoms_y: 4FMSAEBfBgA=
atoms_z: AAAAADDoCgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "O"]
atoms_aniso_u11: oJYAAFjdAQA=
atoms_aniso_u22: oJYAAEioAAA=
atoms_aniso_u33: CJgAACjrAAA=
atoms_aniso_u12: EPr//4jm//8=
atoms_aniso_u13: uBUAAJhJAAA=
atoms_aniso_u23: SOr//5gNAAA=
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAgAABAAAAAABAAAAAUABAAQAEgAAAAAgAAEEBAAAoDEIAgAARAAiJEACBAARCDAUYgAgQYOAQkgBAICEJIUmECCkYiRCIIQBkRJASMIUjJqASRKqhYgTKtAsIINVqdEiK7TQgEBZ1SMlT==


formula: Si O2
compound: <missing>
pub_title: The pressure behavior of alpha cristobalite P = 0.19 GPa
formula_title: <missing>
a: 4.9501
b: 4.9501
c: 6.8760
alpha: 90
beta: 90
gamma: 90
cell_volume: 168.486
crystal_density: 2.369
atoms_sites: ["Si", "O"]
atoms_x: sHkSAECTDgA=
atoms_y: sHkSAOCgBgA=
atoms_z: AAAAABAXCwA=
atoms_occupancy: 0
atoms_u_iso: SJ4AAGjxAAA=
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAgAABAAAAAAAgAAAAKAAgAIACIAAAAAQAABBAIAAJAxCAIAAEQAIRQgAgQACIgQEjEAIBDBQCEYAIBAIhJBGwQIUJjRCRAiAFiNYBIhi0KkwBTKqzDhBIumAwQgsXc6GNt6phAUCtlqoz==


formula: Si O2
compound: <missing>
pub_title: The pressure behavior of alpha cristobalite P = 0.73 GPa
formula_title: <missing>
a: 4.9028
b: 4.9028
c: 6.7782
alpha: 90
beta: 90
gamma: 90
cell_volume: 162.931
crystal_density: 2.449
atoms_sites: ["Si", "O"]
atoms_x: 4NUSAMBtDgA=
atoms_y: 4NUSAOBPBwA=
atoms_z: AAAAAOBpCwA=
atoms_occupancy: 0
atoms_u_iso: sHwAALjTAAA=
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAIAAAQAAAAAAEAAAACQAIABAAQgAAAABAAAIBAgAAkFBIAQAAIQAgUQQBAgAIJAYJDEAIAVCUBEIACAIERDAiyQCSCwoQYgFABMmWAFYSjBHmAiqDEkTIJxYEChECaxqc1W0kgiBCTZGz==


formula: Si O2
compound: <missing>
pub_title: The pressure behavior of alpha cristobalite P = 1.05 GPa
formula_title: <missing>
a: 4.8757
b: 4.8757
c: 6.7163
alpha: 90
beta: 90
gamma: 90
cell_volume: 159.663
crystal_density: 2.500
atoms_sites: ["Si", "O"]
atoms_x: 0BITAEBhDgA=
atoms_y: 0BITANC+BwA=
atoms_z: AAAAAACfCwA=
atoms_occupancy: 0
atoms_u_iso: 8GQAAJDdAAA=
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAEAAAIAAAAAABAAAAAkACAAgAEEAAAAAIAACAIEAAIhIKACAACCAICiBAEEAAgoEhEUQBAAoJIIQwAIAQBEMFKNADECiYgpAEACSMxANhCNCDYBCUJtEgkSxsDMKEC1i8FjK0hkKBAVch==


formula: Si2.808 Al1.207 Fe.4 Mg.512 Mn.007 Ti.067 Na.034 K1.906 O12
compound: <missing>
formula_title: <missing>
a: 5.335
b: 9.244
c: 10.206
alpha: 90
beta: 100.08
gamma: 90
cell_volume: 495.558
crystal_density: 2.795
atoms_sites: ["SiT", "AlT", "Al1", "Fe1", "Mg1", "Mn1", "Ti1", "Na2", "K2", "O1", "O2", "O3", "O4"]
atoms_x: AJcEAACXBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA8IEBALClEwBgJAgA0PAHAA==
atoms_y: 0C8KANAvCgAAAAAAAAAAAAAAAAAAAAAAAAAAAHBnFABwZxQAAAAAAABCDgAwOQoAgIQeAA==
atoms_z: IMgNACDIDQCAhB4AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AgE0KALBFCgCQ1RcAAB8YAA==
atoms_occupancy: wNgqAEAwEgBg6gAAAGoYAABAHwBgbQAA4BYEAKAJAQCgKjoAAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: 0
atoms_aniso_label: ["SiT", "AlT", "Al1", "Fe1", "Mg1", "Mn1", "Ti1", "Na2", "K2", "O1", "O2", "O3", "O4"]
atoms_aniso_u11: kF8BAJBfAQCgdwEAoHcBAKB3AQCgdwEAoHcBAGBdAQBgXQEASJwCAPjOAQBQrgEAgLABAA==
atoms_aniso_u22: CAEBAAgBAQAIAQEACAEBAAgBAQAIAQEACAEBAKgpAQCoKQEA+D0BAFBTAgCoKQEAcGYBAA==
atoms_aniso_u33: oJ8BAKCfAQB4FwIAeBcCAHgXAgB4FwIAeBcCAIjfAQCI3wEAgDcCAIAPAgCA5wEAkP8BAA==
atoms_aniso_u12: WPj//1j4//8AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHir//8AAAAAAAAAAA==
atoms_aniso_u13: 0FcAANBXAAB4lgAAeJYAAHiWAAB4lgAAeJYAAAh1AAAIdQAA0FcAAAiOAAAYeQAA0HAAAA==
atoms_aniso_u23: WAcAAFgHAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAPDT//9gHQAAAAAAAA==
pub_title:
 Crystal chemistry and microstructures of plutonic biotite
 Sample 1M from Valle del Cervo syenitic complex

qdat:
AAAAAAAAAAEAAAAAAAAABACgAgCAAABIAIAAAACJAGAgAJUEUBEAYQBgBAAJpEEECAkCjpAwAgFgJQBFIBZoYbqMBxCTItEpUwVro4CjVsqWUGWLwaKRL9SOzTJ4vjIrx8phUrBYzCWMrQ8CZjSQnqWL7JMYTODkk2PuOz==


formula: (Si2.784 Al1.216) Fe1.215 Mg1.545 Mn.018 Ti.225 K.946 Na.032 O12
compound: <missing>
formula_title: <missing>
a: 5.339
b: 9.249
c: 20.196
alpha: 90
beta: 95.06
gamma: 90
cell_volume: 993.400
crystal_density: 3.062
atoms_u_iso: 0
pub_title:
 Crystal chemistry and microstructures of plutonic biotite
 Sample 2M1 from Valle del Cervo syenitic complex

atoms_sites:
["SiT1", "AlT1", "SiT2", "AlT2", "Fe1", "Mg1", "Mn1", "Ti1", "Fe2", "Mg2", "Mn2", "Ti2", "K", "Na", "O11", "O21", "O22", "O31", "O32", "O4"]

atoms_x:
8CocAPAqHABA0DoAQNA6AMDGLQDAxi0AwMYtAMDGLQAQGA8AEBgPABAYDwAQGA8AAAAAAAAAAAAQEy0AAHQOACD3GgBAZBoAcB85APASOQA=

atoms_y:
ID8PACA/DwBgbRkAYG0ZAEBCDwBAQg8AQEIPAEBCDwAQCQUAEAkFABAJBQAQCQUAQDMFAEAzBQCAYhMAYDoVAMAmBQCAgA4AcLMYAPA9BAA=

atoms_z:
oFwIAKBcCAAwXggAMF4IAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQEIPAEBCDwCAGwoAkCkKAOAkCgBgWwMAYFsDAGApAwA=

atoms_occupancy:
AHsqAACOEgAAeyoAAI4SACC4GADgbh8AwF0AAOCTBAAguBgA4G4fAMBdAADgkwQAQL05AAD0AQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_aniso_label:
["SiT1", "AlT1", "SiT2", "AlT2", "Fe1", "Mg1", "Mn1", "Ti1", "Fe2", "Mg2", "Mn2", "Ti2", "K", "Na", "O11", "O21", "O22", "O31", "O32", "O4"]

atoms_aniso_u11:
oKUAAKClAAAoqgAAKKoAAIiaAACImgAAiJoAAIiaAADI+gAAyPoAAMj6AADI+gAA0BQCANAUAgDAIAEAKEABAGBxAQCYtwAAYNsAAKDmAAA=

atoms_aniso_u22:
yJsAAMibAACAogAAgKIAANjRAADY0QAA2NEAANjRAABw3wAAcN8AAHDfAABw3wAAcCQCAHAkAgBQWQEA+CkBAFgBAQCgKAAA6JQAAJiAAAA=

atoms_aniso_u33:
OOAAADjgAAA44AAAOOAAAEAAAQBAAAEAQAABAEAAAQBAAAEAQAABAEAAAQBAAAEA0KACANCgAgBYYAEAWGABAFhgAQAooAAAMMAAAEggAQA=

atoms_aniso_u12:
uAsAALgLAACIEwAAiBMAAOjg///o4P//6OD//+jg//9I9P//SPT//0j0//9I9P//AAAAAAAAAACQxf//6CYAADAbAAAw+P//0AcAAOgmAAA=

atoms_aniso_u13:
4BAAAOAQAADgEAAA4BAAAHgZAAB4GQAAeBkAAHgZAADoIQAA6CEAAOghAADoIQAAODsAADg7AADoIQAAAAAAADg7AAAAAAAA6CEAAFgqAAA=

atoms_aniso_u23:
sA4AALAOAACwDgAAsA4AABjF//8Yxf//GMX//xjF///I0///yNP//8jT///I0///AAAAAAAAAABQ8f//UPH//8jT//9Q8f//eOL//2i2//8=

qdat:
AAAAAAAAAAIAAAAAAAAABACSAiAEEABQgAEBAAEJgiBAIcUJgxAY4CigBgcB9VNEiYlH6qQyjgjggwNKOD9VSDIUxIVas4ahVDZanChl2cUVV0HSEe9ZRnWt/bu5LJflvNjYZKkROFNEnC22cUUpFv5qhJKKQEi3axwutZ==


formula: Si6 Mn6.682 O23
compound: <missing>
pub_title: Structure and polytypism of bementite, a modulated layer silicate
formula_title: <missing>
a: 14.838
b: 17.584
c: 14.700
alpha: 90
beta: 95.54
gamma: 90
cell_volume: 3817.483
crystal_density: 3.144
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
atoms_sites:
["Si1", "Si2", "Si3", "Si4", "Si5", "Si6", "Si7", "Si8", "Si9", "Si10", "Si11", "Si12", "Mn1", "Mn2", "Mn3", "Mn4", "Mn5", "Mn6", "Mn7", "Mn8", "Mn9", "Mn10", "Mn11", "Mn12", "Mn13", "Mn14", "Mn15", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "O20", "O21", "O22", "O23", "O24", "O25", "O26", "O27", "O28", "O29", "O30", "O31", "O32", "O33", "O34", "O35", "O36", "O37", "O38", "O39", "O40", "O41", "O42", "O43", "O44", "O45", "O46"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAAAAAQAIABQBYNEGGYJY5B9AxPq4Xj8/h3u/e+z+ev3rfK3f/+//r////v/99////v///////////////7/7r/9f3/v/3fe/f9+3q73eVjWuA4ULABCAIAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Pb3.746 (Si18.192 Al5.808) O59.5 H19
compound: <missing>
formula_title: <missing>
a: 19.434
b: 19.702
c: 7.538
alpha: 90
beta: 90
gamma: 90
cell_volume: 2886.215
crystal_density: 2.779
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:
 Maricopaite, an unusual lead calcium zeolite with an interrupted mordenite-like
 framework and intrachannel Pb4 tetrahedral clusters

atoms_sites:
["Pb1", "Pb2", "Pb3", "Pb4", "Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "Si6", "Al6", "Si7", "Al7", "Si8", "Al8", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "Wat19", "Wat20", "Wat21", "Wat22", "Wat23", "Wat24", "Wat25", "Wat26", "Wat27", "Wat28"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAAAIAAAADBAABRQAIIAdgDgAShIh9DYD4+DCGS8xvb6/BW0Pb89/5Vfv3v+n2O8/i++v9fh9uyT6d1OXQO/3yufJ7F8X2k1sn7x82i+NMHtnWbfaJTaLC+x6gex60ttSWlcZ9lSZC/W8804vR9D6cUYUBgEAQAAAAAAA==


formula: Mg O2 D1.998
compound: <missing>
formula_title: <missing>
a: 3.1382
b: 3.1382
c: 4.713
alpha: 90
beta: 90
gamma: 120
cell_volume: 40.197
crystal_density: 2.492
atoms_sites: ["Mg", "O", "D"]
atoms_x: AAAAAFVYFABgZhYA
atoms_y: AAAAAKuwKADAzCwA
atoms_z: AAAAAMAPDQCAJRkA
atoms_occupancy: AAk9AAAJPQAgUxQA
atoms_u_iso: IE4AACBOAACgCQEA
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:
 Pressure-induced H bonding: Neutron diffraction study of brucite, Mg(OD)2, to
 9.3 GPa
 P = 0.4 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAAAEAAAAAEAAAAAAAAAAAAABAAAAAAACAAAIAAAAAAgAAQAAAAAAABgAAAAIABAAAABgAIAAAAAAwAAACAGAAABABAAAAACAAAMAYAABgDAAAABAAAQBAAAwCAAAAIAAAAg==


formula: Mg O2 D1.998
compound: <missing>
formula_title: <missing>
a: 3.1167
b: 3.1167
c: 4.630
alpha: 90
beta: 90
gamma: 120
cell_volume: 38.949
crystal_density: 2.572
atoms_sites: ["Mg", "O", "D"]
atoms_x: AAAAAFVYFAAgxBYA
atoms_y: AAAAAKuwKABAiC0A
atoms_z: AAAAAOBdDQCgcxkA
atoms_occupancy: AAk9AAAJPQAgUxQA
atoms_u_iso: YG0AAGBtAAAgywAA
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:
 Pressure-induced H bonding: Neutron diffraction study of brucite, Mg(OD)2, to
 9.3 GPa
 P = 1.9 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAAABAAAAAAwAAAAAAAAAAAAACAAAAAAARAABAAAAAACQABgAAAAAAABEAAAAEAAEAAACgAgAAAAAASQAAIAEUAAAgBAAAAAAEAAJCJQABATAAAAAoAAEECAAUJAIAACwgAA==


formula: Mg O2 D1.998
compound: <missing>
formula_title: <missing>
a: 3.0728
b: 3.0728
c: 4.496
alpha: 90
beta: 90
gamma: 120
cell_volume: 36.764
crystal_density: 2.725
atoms_sites: ["Mg", "O", "D"]
atoms_x: AAAAAFVYFAAgvhcA
atoms_y: AAAAAKuwKABAfC8A
atoms_z: AAAAACD6DQDgjBoA
atoms_occupancy: AAk9AAAJPQAgUxQA
atoms_u_iso: QJwAAECcAACAuwAA
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:
 Pressure-induced H bonding: Neutron diffraction study of brucite, Mg(OD)2, to
 9.3 GPa
 P = 5.4 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAIAAAAACEAAAAAAAAAAAAAAgAAAAAAQBAAgAAAAACAQAUAAAAAAAAEAQAAACAAAQAAQICAAAAAAAgEEAgAIAhAAIBAAAAAAABAIQICEAgCgQAAAIIAAQAEQEQQIAAgQR==


formula: Mg O2 D1.998
compound: <missing>
formula_title: <missing>
a: 3.0365
b: 3.0365
c: 4.403
alpha: 90
beta: 90
gamma: 120
cell_volume: 35.158
crystal_density: 2.849
atoms_sites: ["Mg", "O", "D"]
atoms_x: AAAAAFVYFABAiRgA
atoms_y: AAAAAKuwKACAEjEA
atoms_z: AAAAAAApDgCgZxsA
atoms_occupancy: AAk9AAAJPQAgUxQA
atoms_u_iso: QJwAAECcAABAnAAA
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:
 Pressure-induced H bonding: Neutron diffraction study of brucite, Mg(OD)2, to
 9.3 GPa
 P = 9.3 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAAAABAAAAAAAAAAAAAAABAAAAAAIEAAAAAAAAAAAAAAgAAAAAAgAIAgAAAAACACARAAAAAAAABAAQAAAQAAAQAIBAgAAAAAACAEAkABAAQIAIEAAAAAAAAFAQgAiSAEgAQAAICAAIAAFQIgAIAA==


formula: Mn Al.65 Li.33 O4 H2
compound: <missing>
formula_title: <missing>
a: 2.9247
b: 2.9247
c: 28.169
alpha: 90
beta: 90
gamma: 120
cell_volume: 208.672
crystal_density: 3.361
atoms_sites: ["Mn", "Al", "Li", "O1", "O2", "H"]
atoms_x: AAAAAFVYFABVWBQAq7AoAKuwKACrsCgA
atoms_y: AAAAAKuwKACrsCgAVVgUAFVYFABVWBQA
atoms_z: AAAAADgsCgA4LAoA8BcCAPAMCADgCgYA
atoms_occupancy: AAk9AECsJwBAJBQAAAk9AAAJPQAACT0A
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAUwcA
atoms_aniso_label: ["Mn", "Al", "Li", "O1", "O2"]
atoms_aniso_u11: sMwAABByAAAQcgAAAF4BABBTAQA=
atoms_aniso_u22: sMwAABByAAAQcgAAAF4BABBTAQA=
atoms_aniso_u33: 4PYAAADIAAAAyAAAYBwBAJDJAAA=
atoms_aniso_u12: WGYAAAg5AAAIOQAAAK8AAIipAAA=
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
pub_title:
 Crystal structure refinement of lithiophorite
 Note: U(1,2) for Mn/Al/Li/O2 have been altered to match symmetry constraints.

qdat:
AAAAAAAAAAAQAAAAAAAAAAIAAAAAAAAAAEAAAAAAAEgAgIAABAAgAAACAAAAAAAAAAAAAAACEAAgAAAgAACghACBAACAAAAAAAAAAAAAAAAAAGIgEIAEAAAAAAAAkAgAEAAAAAAAAAAAAAASAgAQARIIgCAAAAAAAAAAAM==


formula: Al2 Si O4 F2
compound: <missing>
formula_title: <missing>
a: 4.652
b: 8.801
c: 8.404
alpha: 90
beta: 90
gamma: 90
cell_volume: 344.079
crystal_density: 3.553
atoms_sites: ["Al", "Si", "O1", "O2", "O3", "F"]
atoms_x: 2B03ALg+GADA8SoAkO8bAGDUDADggiQA
atoms_y: UP0HAPhkOQCQ9QEAgCQuAEBgPABQaQ8A
atoms_z: OA4FAEBCDwBAQg8AQEIPAMCjBQCQbAMA
atoms_occupancy: 0
atoms_u_iso: WEMAAFg5AAAoSwAAME0AAEhJAAD4ZgAA
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:
 The location of H in the high-pressure synthetic Al2SiO4(OH)2 topaz analogue
 Sample fluor-topaz from a Mexican rhyolite

qdat:
AAAAAAAAAAAAAAAAAQAAAAABAiAAIAAAACEiABAQAQACgwGCQjBGFCSQqEVCBACUFMSYeiYNmhCPhZ1gNGIG5pY4yj3fKc60Ff/artXtn7ll+9+rxdZ/9uT5fuvfmbvz73Lvutb+2fdv/X9Tr/73/WfOz/dzXPnd3/92P3==


formula: Al2 Si O6 H2
compound: <missing>
pub_title: The location of H in the high-pressure synthetic Al2SiO4(OH)2 topaz analogue Sample OH synthetic
formula_title: <missing>
a: 4.7203
b: 8.9207
c: 8.4189
alpha: 90
beta: 90
gamma: 90
cell_volume: 354.506
crystal_density: 3.374
atoms_sites: ["Al", "Si", "O1", "O2", "O3", "O-h", "H1", "H2"]
atoms_x: eDw3AIiHGAAAXCsA8BcbAFARDQAgDCQA4AkbAGAMJQA=
atoms_y: EBAIAIhmOQBgmQEAECYuABCaPAAwTQ8AYCUMAKAmEQA=
atoms_z: gN8EAEBCDwBAQg8AQEIPAHDBBQCwBQQAAF8FAGA3CQA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AgIQeAICEHgA=
atoms_u_iso: UEEAAFg5AAAoSwAAQEcAAChLAAD4ZgAAYBYCAAB9BQA=
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:
AAAAAAAAAAAAAAAAAQAAAAAEBEAAgAAAAISIAIAQBAAEIhQkEKRKQUEjiCgYgBEIjBinGUmmgkDIIbqJgsG4wUpDbn6xTLwUO+GWuZ+lHp9bK09H1a/Rlvb+8261L8desd50t7/+n/vs3+npvfrfn279S78fbO6/V0x+Xp==


formula: Mg Si O3
compound: <missing>
pub_title: A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 0 GPa
formula_title: <missing>
a: 18.233
b: 8.8191
c: 5.1802
alpha: 90
beta: 90
gamma: 90
cell_volume: 832.969
crystal_density: 3.202
atoms_sites: ["Mg1", "Mg2", "SiA", "SiB", "O1a", "O2a", "O3a", "O1b", "O2b", "O3b"]
atoms_x: sPcWABABFwAwkhAAAOgcADAzCwCgARMAkHYSAGBQIgBAZBoAsFwbAA==
atoms_y: UOwnAIC8HQCg3BQA4JcUAHDLFADQsR4AAJMNAGDWFABAhB0AcOgLAA==
atoms_z: 8N80ANDnFQCgFgMAULYwAEATAgDgnwIAAMgyAMC0MABAHSoA4M0kAA==
atoms_occupancy: 0
atoms_u_iso: qIQAAFiiAADYcgAAuHQAALh+AADIeAAAKFUAAPi7AADQcAAA0HAAAA==
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:
AAAAAAAAAAAEAAAAEAAAAAAiQBYAAQASBwECEkCAFLsCkEl0pEhixUU0FsSgM17ry+3MShVc6j/ok/JWNzeW97rZn25ut/t6/7jblps9+fpft/9/f89+vZWuH/+3z/3v/Ot7rv1+757azyu3/9ffj774m93z5Lnbxj2te5==


formula: Mg Si O3
compound: <missing>
pub_title: A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 1.04 GPa
formula_title: <missing>
a: 18.186
b: 8.782
c: 5.1610
alpha: 90
beta: 90
gamma: 90
cell_volume: 824.260
crystal_density: 3.236
atoms_sites: ["Mg1", "Mg2", "SiA", "SiB", "O1a", "O2a", "O3a", "O1b", "O2b", "O3b"]
atoms_x: gP8WAKACFwDAkxAAkOkcAHAgCwDw/BIAYH4SADBYIgAwVhoAgEsbAA==
atoms_y: kPInAMCpHQBQ4RQA0IkUAEChFAAAwx4AYJwNAIDAFADgeh0AQNcLAA==
atoms_z: sKc0AEC0FQAg8QIAUM8wAAD0AQDgnwIAIJkyAADUMADA3ikAYAwlAA==
atoms_occupancy: 0
atoms_u_iso: 8GQAALh+AAAIYQAAGFEAADCsAAC4dAAAoCMAALB8AABISQAA+GYAAA==
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:
AAAAAAAAAAAEAAAAEAAAAAAhQA0AAQAJA4EBEUBACl2BSCi2UjQzY6KaDyNIGJ/S4vbnJollOo/6ZP01jc3p/c7WZ9qrs+7ef+U25ebP7n+f99/ez6lNtve5x3/3ef+99133fd+/3/O7Oeb2+/bd+fvWm9X6PtW1vKNa9z==


formula: Mg Si O3
compound: <missing>
pub_title: A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 1.95 GPa
formula_title: <missing>
a: 18.148
b: 8.756
c: 5.1493
alpha: 90
beta: 90
gamma: 90
cell_volume: 818.244
crystal_density: 3.260
atoms_sites: ["Mg1", "Mg2", "SiA", "SiB", "O1a", "O2a", "O3a", "O1b", "O2b", "O3b"]
atoms_x: APMWAID/FgCwhRAAwOEcACAlCwBg4hIA4IoSAGBQIgDwaBoAIFsbAA==
atoms_y: wAMoADCPHQDA+BQAcIAUAMDfFADg8R4AYJwNAIDAFADgeh0AoMcLAA==
atoms_z: wJw0AOCqFQDAzgIAUOgwAGDkAQAAcQIAoFoyAIASMQDgLCoA4EolAA==
atoms_occupancy: 0
atoms_u_iso: gC8AAOBqAACYKwAAkCkAAHgtAAC4HwAAwBcAAChLAACYKwAAeC0AAA==
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:
AAAAAAAAAAAEAAAACAAAAAAgoAsAAIAIg0CBCKAgCjbAyBTfMRIZsdHNBqEkDFf5cXsrkkVynUftEvpWwtX6tvdfM2XL1d+3u/mK+Xun3p+n+X/28/zT7936Uf/V/v/vfVf9z3ds/5yuTnk/vuXv2zb1xP1+x2zPJxzeve==


formula: Mg Si O3
compound: <missing>
pub_title: A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 3.27 GPa
formula_title: <missing>
a: 18.1045
b: 8.7181
c: 5.1327
alpha: 90
beta: 90
gamma: 90
cell_volume: 810.129
crystal_density: 3.292
atoms_sites: ["Mg1", "Mg2", "SiA", "SiB", "O1a", "O2a", "O3a", "O1b", "O2b", "O3b"]
atoms_x: IPYWAOAIFwAwkhAAEN0cAAAiCwAQ5xIAMIYSAEBNIgAgYRoAAD8bAA==
atoms_y: UAUoAICjHQDQ7RQAkJwUANC7FADg8R4AcJENAKDDFADQhR0AkLkLAA==
atoms_z: YHo0AMCOFQBwugIAcOswAOClAQAgQgIAoFoyAGBBMQBg7ikAgFolAA==
atoms_occupancy: 0
atoms_u_iso: ME0AALB8AABYQwAAUEEAAFhDAAAYWwAA8GQAANhyAACgIwAAIFMAAA==
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:
AAAAAAAAAAAEAAAACAAAAAAQoAqAAIAEgcCAiJAQBR5gpApPmIkM2MhmgVC6BSfueJ2dyKJdp2K7TT+lsTn/Lf3ezNlzdTX+5t1ivl5tftf4r3/6/P8ebvs/zD++/97/7+bf+/T+n/OdTI0Xt7yv++bemJuryO6c5uNL15==


formula: Mg Si O3
compound: <missing>
pub_title: A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 4.09 GPa
formula_title: <missing>
a: 18.0710
b: 8.6929
c: 5.1214
alpha: 90
beta: 90
gamma: 90
cell_volume: 804.518
crystal_density: 3.315
atoms_sites: ["Mg1", "Mg2", "SiA", "SiB", "O1a", "O2a", "O3a", "O1b", "O2b", "O3b"]
atoms_x: 4O8WAOAIFwBAhxAA8NkcAEAoCwAQ5xIAoIQSANBOIgCwYhoAgEsbAA==
atoms_y: UAUoAMCQHQDg+xQAgI4UAOCwFADg8R4AAKwNAIDAFADgeh0AALgLAA==
atoms_z: QHc0AIBvFQCQpAIA0PQwAGBnAQBgYQIAoFoyAIASMQBAHSoAgFolAA==
atoms_occupancy: 0
atoms_u_iso: QEcAABBZAACALwAAgC8AAIgxAABoPQAAkCkAAICOAABgOwAA2AkAAA==
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:
AAAAAAAAAAACAAAACAAAAAAQUAaAAIACQWBAhEgQBI9wUgolVEWE7GRzQKhZApX1PE7q5FlO87F9lp/S2Nz/l/7ntnz9ulp/8y+Yuxe+f+V8b5f3fz9Pm/zetw//P/+/9fm3vvX679/ne1Fm7+W7m/r3rxer9imzPaxX2/==


formula: Mg Si O3
compound: <missing>
pub_title: A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 4.95 GPa
formula_title: <missing>
a: 18.0455
b: 8.6708
c: 5.1119
alpha: 90
beta: 90
gamma: 90
cell_volume: 799.854
crystal_density: 3.335
atoms_sites: ["Mg1", "Mg2", "SiA", "SiB", "O1a", "O2a", "O3a", "O1b", "O2b", "O3b"]
atoms_x: APMWAOAIFwCQghAAgNscALAmCwBQ1BIAIJESADA/IgDQZRoAYEgbAA==
atoms_y: gP0nAACXHQCA8hQA8KUUAOCwFACAAR8AYJwNAIDAFACAih0AwJgLAA==
atoms_z: 4G00AMBcFQCggAIAYPYwAAB3AQDgIgIAQGoyACAiMQAgzykAIGolAA==
atoms_occupancy: 0
atoms_u_iso: eDcAAPBkAABIPwAAsB0AAFBBAADQEQAAuBUAAFhDAABYQwAA6A0AAA==
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:
AAAAAAAAAAACAAAACAAAAAAQUAVAAEACQWBAREgIAo8wMQU3qiaGdnI6wKxsglP6ri9lciim+diuUs9prE2vy+9Ter5OvSy/2ZbsZcuvH7rWNc//35/zr9dm9cP32v///vx7975e+3843IjTu3/pru59qYly/o/s7iYc/3==


formula: Mg Si O3
compound: <missing>
pub_title: A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 5.85 GPa
formula_title: <missing>
a: 18.011
b: 8.652
c: 5.102
alpha: 90
beta: 90
gamma: 90
cell_volume: 795.051
crystal_density: 3.355
atoms_sites: ["Mg1", "Mg2", "SiA", "SiB", "O1a", "O2a", "O3a", "O1b", "O2b", "O3b"]
atoms_x: sPcWAMAFFwBgihAA8NkcAFAdCwCg6BIAoIQSAFBCIgBAZBoAwDgbAA==
atoms_y: ACMoANCFHQDA+BQAgI4UAAD/FACAAR8AwIwNAEChFAAgmh0AwJgLAA==
atoms_z: EE00AJBLFQDghgIAAAYxAAB3AQAA9AEAgAwyAOB/MQDA3ikAIGolAA==
atoms_occupancy: 0
atoms_u_iso: 8GQAADhPAABwNQAAeDcAAHgtAADIeAAA6AMAAPhmAACIJwAAiCcAAA==
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:
AAAAAAAAAAACAAAABAAAAAAIUAVAAEACINBARCQIAke4KQUTqhLCVjIZoFYuQSn3Vxe0sRRXfMxfZWe1Nia/5f+Z650n31Zd7s12O+W3z/1vi/bu7uv50+er1mD/5//v/vc29/aX7P+0Z9Y0//bduT+v+uNuv2LbMtuNfb==


formula: Mg Si O3
compound: <missing>
pub_title: A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 7.00 GPa
formula_title: <missing>
a: 17.983
b: 8.6241
c: 5.0902
alpha: 90
beta: 90
gamma: 90
cell_volume: 789.425
crystal_density: 3.379
atoms_sites: ["Mg1", "Mg2", "SiA", "SiB", "O1a", "O2a", "O3a", "O1b", "O2b", "O3b"]
atoms_x: IPYWAHAKFwDwixAA0NYcAEAoCwAA2RIAQJQSADBYIgCgbRoAcFYbAA==
atoms_y: AAooAFCSHQDw8BQAUJYUAIDAFAAgER8AYJwNAACCFAAgmh0AwJgLAA==
atoms_z: 8Ek0AAAxFQBwbwIAcAQxACBIAQCgAwIAoN0xAICPMQDA3ikAIGolAA==
atoms_occupancy: 0
atoms_u_iso: UEEAAPhcAABIPwAAaDMAABhRAAAAXwAAYDsAAOhsAAC4HwAAqCUAAA==
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:
AAAAAAAAAAACAAAABAAAAAAIKAMgACABILAgIiQEAUNcGIMZVQtjOxkM4DYXIJT6q4urWIpLvlIrmrNVlxNb0nvOf6XL66e/87JdnfpvZ/dawvW7O+v+8v3q/nhf+P///9vH3b+t/7/tje2Ou2+fWq/n3pifp9j1RvZhv3==


formula: Mg Si O3
compound: <missing>
pub_title: A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 8.10 GPa
formula_title: <missing>
a: 17.950
b: 8.604
c: 5.080
alpha: 90
beta: 90
gamma: 90
cell_volume: 784.564
crystal_density: 3.400
atoms_sites: ["Mg1", "Mg2", "SiA", "SiB", "O1a", "O2a", "O3a", "O1b", "O2b", "O3b"]
atoms_x: YPwWAOAIFwAAgRAAoN4cAGASCwCgzxIAwIcSACAxIgCgbRoAsCobAA==
atoms_y: UDcoACCBHQDA+BQA8KUUAAD/FAAgER8AwIwNAIDAFADAqR0AYKgLAA==
atoms_z: 4Ds0AGAhFQCQWQIAoBUxAMBXAQBg5AEAgAwyAICPMQBAoCkAYIklAA==
atoms_occupancy: 0
atoms_u_iso: yG4AAPBkAABwNQAAeDcAAHA1AAAYUQAAqHoAAMhuAACoJQAA2BMAAA==
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:
AAAAAAAAAAACAAAABAAAAAAIKAKgACABEGggIiIEASLcFEGJyomhnYyOsDsboEq91cXVPEUl3xkXzVn9S82v6T3lPtPl9dLf2dkuzly/8uudsX6/3d19rX77f64X7v/u/+7h+37pv2v1RX9yb9b/17P27q8nxvYXY7Soc/==


formula: Mn49 (Si64.512 Al7.488) O218 K7.512
compound: <missing>
formula_title: <missing>
a: 39.1
b: 22.84
c: 17.95
alpha: 90
beta: 135.6
gamma: 90
cell_volume: 11215.699
crystal_density: 2.513
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
pub_title:
 The use of electron optical methods to determine the crystal structure of a
 modulated phyllosilicate: Parsettensite

atoms_sites:
["Mn1", "Mn2", "Mn3", "Mn4", "Mn5", "Mn6", "Mn7", "Mn8", "Mn9", "Mn10", "Mn11", "Mn12", "Mn13", "Mn14", "Mn15", "Mn16", "Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "Si6", "Al6", "Si7", "Al7", "Si8", "Al8", "Si9", "Al9", "Si10", "Al10", "Si11", "Al11", "Si12", "Al12", "Si13", "Al13", "Si14", "Al14", "Si15", "Al15", "Si16", "Al16", "Si17", "Al17", "Si18", "Al18", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "O20", "O21", "O22", "O23", "O24", "O25", "O26", "O27", "O28", "O29", "O30", "O31", "O32", "O33", "O34", "O35", "O36", "O37", "O38", "O39", "O40", "O41", "O42", "O43", "O44", "O45", "O46", "O47", "O48", "O49", "O50", "O51", "O52", "O53", "O54", "O55", "O56", "O57", "O58", "O59", "O60", "O61", "K1", "K2", "K3", "K4", "K5", "K6", "K7", "K8"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

qdat:
AAAAAAgCIQAAoAJICJojQAh1niWUOfT04OnL3+6ee/H4e/317Xje8+ndnf/3q727u4v7N+fJ+3+/d+vznzOvzbuV2/J699n9b5xvTVi0N5aFgoHkwkoYBQQCAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Fe2 Si3 O9
compound: <missing>
formula_title: <missing>
a: 22.20
b: 22.20
c: 17.835
alpha: 125.03
beta: 95.98
gamma: 120.0
cell_volume: 5199.102
crystal_density: 2.606
atoms_occupancy: 0
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
pub_title:
 Stilpnomelane and parsettensite: A distance least squares (DLS) study
 Note: this is a theoretical structure

atoms_sites:
["Fe1", "Fe2", "Fe3", "Fe4", "Fe5", "Fe6", "Fe7", "Fe8", "Fe9", "Fe10", "Fe11", "Fe12", "Fe13", "Fe14", "Fe15", "Fe16", "Fe17", "Fe18", "Fe19", "Fe20", "Fe21", "Fe22", "Fe23", "Fe24", "Si1", "Si2", "Si3", "Si4", "Si5", "Si6", "Si7", "Si8", "Si9", "Si10", "Si11", "Si12", "Si13", "Si14", "Si15", "Si16", "Si17", "Si18", "Si19", "Si20", "Si21", "Si22", "Si23", "Si24", "Si25", "Si26", "Si27", "Si28", "Si29", "Si30", "Si31", "Si32", "Si33", "Si34", "Si35", "Si36", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "O20", "O21", "O22", "O23", "O24", "O25", "O26", "O27", "O28", "O29", "O30", "O31", "O32", "O33", "O34", "O35", "O36", "O37", "O38", "O39", "O40", "O41", "O42", "O43", "O44", "O45", "O46", "O47", "O48", "O49", "O50", "O51", "O52", "O53", "O54", "O55", "O56", "O57", "O58", "O59", "O60", "O61", "O62", "O63", "O64", "O65", "O66", "O67", "O68", "O69", "O70", "O71", "O72", "O73", "O74", "O75", "O76", "O77", "O78", "O79", "O80", "O81", "O82", "O83", "O84", "O85", "O86", "O87", "O88", "O89", "O90", "O91", "O92", "O93", "O94", "O95", "O96", "O97", "O98", "O99", "O100", "O101", "O102", "O103", "O104", "O105", "O106", "O107", "O108"]

atoms_x:

atoms_y:

atoms_z:

qdat:
AAAAAAEAiAAAAoAJAQAaJEBDALyBSBCC2UaMMAdzmJB4NjbaokG/4XSmY/z1z+m/16/hX3/u/rmj///f4+f/37r/3///+//9///+/d/3//7/////9v/f79/71+/n/vv7f/9/7q/p///55d+X7l+9muqf3rnyJk39cmbIaJ==


formula: Si8 Mg2.3 Al.14 Ti.41 Fe.96 Mn.52 Li.67 Na2.7 Ca.1 K.15 H.97 O23.79 F.21
compound: Kajlidongri, Madhya Pradesh, India
pub_title: The mechanism of Li incorporation in amphiboles Sample: A1
formula_title: <missing>
a: 9.748
b: 17.842
c: 5.287
alpha: 90
beta: 104.12
gamma: 90
cell_volume: 891.753
crystal_density: 3.159
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
atoms_sites:
["Si1", "Si2", "Mg1", "Al1", "Ti1", "Fe1", "Mn1", "Mg2", "Al2", "Fe2", "Mn2", "Li3", "Mg3", "Na4", "Ca4", "NaA", "KA", "NaAm", "KAm", "NaA2", "KA2", "H", "O1", "O2", "O3", "O-h3", "F3", "O4", "O5", "O6", "O7"]

atoms_x:
MCgRABCiEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADAGQMAwBkDAAAAAAAAAAAAMGULADDOBgCgMAcAAL0GAAC9BgAAvQYA0AAWAMBcFQAAGBUAILcUAA==

atoms_y:
EDsFAOBvCgDwBQUA8AUFAPAFBQDwBQUA8AUFAED2CgBA9goAQPYKAED2CgAAAAAAAAAAAHDKEABwyhAAgIQeAICEHgCAhB4AgIQeAICQHACAkBwAAAAAAGBoBQBALgoAAAAAAAAAAAAAAAAAwE4PAADQBwDgTwcAAAAAAA==

atoms_z:
kOARAODQMACAhB4AgIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AAAAAAAAAAACwqAYAsKgGAAAAAAAAAAAAED8uAHAtDQBgXywA0IIqANCCKgDQgioAIPAwAAD7BABwiiMAsC4SAA==

atoms_occupancy:
AAk9AAAJPQBAyiIAoIYBACCDDABA7wcAwEUEAGBUGQAgvwIAwFwVAMCYCwDA5CgAQCQUAMD7OQBADQMAAMQJAMDUAQAAxAkAwNQBAADECQDA1AEAIJodAAAJPQAACT0AQAYZACCaHQCgaAYAAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
GFEAACBTAACAjgAAgI4AAICOAACAjgAAgI4AAABfAAAAXwAAAF8AAABfAACQiAAAkIgAAJDnAACQ5wAAQAYFAEAGBQD4NwIA+DcCABieAwAYngMAYAwCALB8AADAdgAAeJYAAHiWAAB4lgAASJ4AAGiSAACIkAAAQKYAAA==

qdat:
AAAAAAAAAAACEAAAAAAAFAQEAgQAAAA4IDAUACBADiEEIREwaAQwpSoCSCykBY6DEWkWQon0AFQzHTNUAL3Cp4jRC7kqLjcOeikB/U7FXEfRhueZZRQwTPkt5OuSNLNmqzJZUgrOuAgszgumMke5IxPSlonMB5AT47BPoc==


formula: Si7.92 Al.26 Mg2.24 Fe1.42 Mn.42 Li.74 Na2.71 Ca.04 K.2 H1.28 O23.5 F.48
compound: Kajlidongri, Madhya Pradesh, India
pub_title: The mechanism of Li incorporation in amphiboles Sample: A2
formula_title: <missing>
a: 9.790
b: 17.848
c: 5.287
alpha: 90
beta: 104.10
gamma: 90
cell_volume: 895.975
crystal_density: 3.149
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
atoms_sites:
["Si1", "Al1", "Si2", "Al2", "Mg1", "Al1", "Fe1", "Mn1", "Mg2", "Al2", "Fe2", "Mn2", "Li3", "Mg3", "Na4", "Ca4", "NaA", "KA", "NaAm", "KAm", "NaA2", "KA2", "H", "O1", "O2", "O3", "O-h3", "F3", "O4", "O5", "O6", "O7"]

atoms_x:
kP8QAJD/EAAQohEAEKIRAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAO4CAADuAgAAAAAAAAAAACAlCwDguQYAID0HADDOBgAwzgYAMM4GAAArFgAQWBUAMPcUAEBvFAA=

atoms_y:
4EIFAOBCBQAAcwoAAHMKAJBHBQCQRwUAkEcFAJBHBQBA9goAQPYKAED2CgBA9goAAAAAAAAAAADA3hAAwN4QAICEHgCAhB4AgIQeAICEHgCA9BwAgPQcAAAAAAAQhgUA4FYKAAAAAAAAAAAAAAAAAIBIDwDQ1wcAgEYHAAAAAAA=

atoms_z:
YOgRAGDoEQDw9zAA8PcwAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAAAAAAAAAAAAQEYGAEBGBgAAAAAAAAAAAPDELAAgGQ0AsKUsAKC8KgCgvCoAoLwqACDwMACwMQUA0KwjALAVEgA=

atoms_occupancy:
wGw8AECcAADAbDwAQJwAAMCoMgAAcQIAgBoGAMDUAQAAxAkAQA0DAEA7JQCA/AoAgCotAIDeDwCA0DsAgDgBAMAnCQAAcQIAwCcJAABxAgDAJwkAAHECAAAQJwAACT0AAAk9AMC2BgAAECcAAKYOAAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
KFUAAChVAAAoVQAAKFUAAOBqAADgagAA4GoAAOBqAAAAXwAAAF8AAABfAAAAXwAAaJwAAGicAACg4QAAoOEAAKBTAgCgUwIAQMMBAEDDAQDAwwMAwMMDALD4AQCYgAAAoIIAAAC+AAAAvgAAAL4AAFCgAABYmAAAiJAAABC4AAA=

qdat:
AAAAAAAAAAACEAAAAAAAFAgEAgQAAAA4QGAUAEBADkEIQSIwaAgxqlwEUDDIBZeEEWQ0iJz0AFBmPeZwATGDVxLkYmlIjE8tspQK3VtN1F1Wktcjd1BRqlE7C7UwanvWnmzZyCezqDE0mAs8cwaahxNDfJUIJ0BFgsCbgY==


formula: Si7.92 Al.26 Mg2.24 Fe1.42 Mn.42 Li.74 Na2.71 Ca.04 K.2 H1.28 O23.5 F.48
compound: Kajlidongri, Madhya Pradesh, India
formula_title: <missing>
a: 9.822
b: 17.836
c: 5.286
alpha: 90
beta: 104.37
gamma: 90
cell_volume: 897.056
crystal_density: 3.145
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:
 The mechanism of Li incorporation in amphiboles
 Sample: A3
 Note: Site occupancies are set to be the same as ones in sample A2

atoms_sites:
["Si1", "Al1", "Si2", "Al2", "Mg1", "Al1", "Fe1", "Mn1", "Mg2", "Al2", "Fe2", "Mn2", "Li3", "Mg3", "Na4", "Ca4", "NaA", "KA", "NaAm", "KAm", "NaA2", "KA2", "H", "O1", "O2", "O3", "O-h3", "F3", "O4", "O5", "O6", "O7"]

atoms_x:
wPcQAMD3EACwmBEAsJgRAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAcG8CAHBvAgAAAAAAAAAAANBCCwDAtgYAADoHAGDGBgBgxgYAYMYGAPAcFgDgRhUAwPgUAKBfFAA=

atoms_y:
4EIFAOBCBQAAcwoAAHMKAAAtBQAALQUAAC0FAAAtBQBA9goAQPYKAED2CgBA9goAAAAAAAAAAAAw3RAAMN0QAICEHgCAhB4AgIQeAICEHgDgFh0A4BYdAAAAAAAQhgUA0EgKAAAAAAAAAAAAAAAAAIBIDwCQ0QcAEEgHAAAAAAA=

atoms_z:
APgRAAD4EQAg8DAAIPAwAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAAAAAAAAAAAAIK0FACCtBQAAAAAAAAAAABAHLwCgJQ0AQHUsAHCSKgBwkioAcJIqADD+MAAgMAUA4LojAPA0EgA=

atoms_occupancy:
wGw8AECcAADAbDwAQJwAAMCoMgAAcQIAgBoGAMDUAQAAxAkAQA0DAEA7JQCA/AoAgCotAIDeDwCA0DsAgDgBAMAnCQAAcQIAwCcJAABxAgDAJwkAAHECAAAQJwAACT0AAAk9AMC2BgAAECcAAKYOAAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
GFsAABhbAAAQWQAAEFkAAJiKAACYigAAmIoAAJiKAADoYgAA6GIAAOhiAADoYgAAkIgAAJCIAABg7wAAYO8AAIB8AwCAfAMAGCwCABgsAgA4MwMAODMDAHhnAgB4jAAAeJYAACi0AAAotAAAKLQAABiwAABokgAAaJIAABi6AAA=

qdat:
AAAAAAAAAAACEAAAAAAAFAgGAgQAAAA4QEAUAEBADkEIwMEwaBAxqiwIYDDEBY+GIWg6SJRcAJjFNNNgAjmCnZL8p1S0RmrT2ZgT7MqoxDW80d6zcSAdNVmfA16QOj1yjpmo1A347BTcTAWaLkctIYSgm0bmEeAT4SBOoV==


formula: Si7.92 Al.16 Mg3.34 Fe1.174 Mn.126 Ti.04 Li.24 Na2.45 Ca.1 K.2 H2 O23.58 F.42
compound: <missing>
formula_title: <missing>
a: 9.771
b: 17.887
c: 5.289
alpha: 90
beta: 103.82
gamma: 90
cell_volume: 897.619
crystal_density: 3.106
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:
 The mechanism of Li incorporation in amphiboles
 Sample: A4
 Note: Site occupancies are set to be the same as ones in sample A5

atoms_sites:
["Si1", "Al1", "Si2", "Al2", "Mg1", "All", "Fe1", "Mn1", "Mg2", "Ti2", "Fe2", "Mn2", "Li3", "Mg3", "Na4", "Ca4", "NaA", "KA", "NaAm", "KAm", "NaA2", "KA2", "H", "O1", "O2", "O-h3", "F3", "O4", "O5", "O6", "O7"]

atoms_x:
0B4RANAeEQDQmxEA0JsRAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA4OoCAODqAgAAAAAAAAAAALCKCwCAyQYA4DYHAJClBgCQpQYAUCYWANBRFQCQ5xQAoJEUAA==

atoms_y:
EDsFABA7BQAgdgoAIHYKACBiBQAgYgUAIGIFACBiBQCQCgsAkAoLAJAKCwCQCgsAAAAAAAAAAABQ4BAAUOAQAICEHgCAhB4AgIQeAICEHgBgjRwAYI0cAAAAAACQYAUAcFgKAAAAAAAAAAAAgEgPAHDnBwAwSwcAAAAAAA==

atoms_z:
IOIRACDiEQCQ7jAAkO4wAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAAAAAAAAAAAAMFEGADBRBgAAAAAAAAAAADAQLgAQCw0A4LYsADA7KwAwOysAUM8wAAAtBQAQmiMAUAwSAA==

atoms_occupancy:
wGw8AECcAADAbDwAQJwAAEDDOAAAcQIA4KUBAOAuAAAA+RUAgDgBAAAuIgCAqQMAAKYOAABjLgDA+zkAQA0DAMC2BgAAcQIAwLYGAABxAgDAtgYAAHECAAAJPQAACT0AAAk9AMA3MABA0QwAAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
ME0AADBNAAA4TwAAOE8AAPhmAAD4ZgAA+GYAAPhmAAD4XAAA+FwAAPhcAAD4XAAA4GoAAOBqAADI1wAAyNcAAFDtAwBQ7QMA2EMCANhDAgCIfgMAiH4DAFgxAwDgagAA0HAAAHiWAAB4lgAAaJIAAHCUAAB4jAAAOKQAAA==

qdat:
AAAAAAAAAAACEAAAAAAAKAgEAggAAABoQGAYAEBADEMQQSJg0AhhTFQEoFGICx8EIuRtCzXoALCsMszQAWOErSPEJtSpGN4xySQFpkqlyK9FK8rpXSDDbsVqp1rhk62+bWt1kHTLwOKsYGixzD7qGCoN7D4gZQCaFgR+Dh==


formula: Si7.92 Al.16 Mg3.34 Fe1.174 Mn.126 Ti.04 Li.24 Na2.45 Ca.1 K.2 H2 O23.58 F.42
compound: <missing>
pub_title: The mechanism of Li incorporation in amphiboles Sample: A5
formula_title: <missing>
a: 9.779
b: 17.888
c: 5.287
alpha: 90
beta: 103.85
gamma: 90
cell_volume: 897.949
crystal_density: 3.105
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
atoms_sites:
["Si1", "Al1", "Si2", "Al2", "Mg1", "Al1", "Fe1", "Mn1", "Mg2", "Ti2", "Fe2", "Mn2", "Li3", "Mg3", "Na4", "Ca4", "NaA", "KA", "NaAm", "KAm", "NaA2", "KA2", "H", "O1", "O2", "O-h3", "F3", "O4", "O5", "O6", "O7"]

atoms_x:
IBoRACAaEQBAmhEAQJoRAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAcOwCAHDsAgAAAAAAAAAAADCdCgDwxwYA4DYHALCoBgCwqAYAMCMWAEBQFQAg6RQAEJAUAA==

atoms_y:
EDsFABA7BQCQdAoAkHQKAFBaBQBQWgUAUFoFAFBaBQBwBwsAcAcLAHAHCwBwBwsAAAAAAAAAAADA3hAAwN4QAICEHgCAhB4AgIQeAICEHgDgZxwA4GccAAAAAAAgYgUAUFUKAAAAAAAAAAAA8EYPAODlBwAQSAcAAAAAAA==

atoms_z:
QOURAEDlEQAA7TAAAO0wAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAAAAAAAAAAAAYDAGAGAwBgAAAAAAAAAAAFBkLQDgEg0AYKosALAuKwCwLisAwM0wAJAuBQDAniMAwAoSAA==

atoms_occupancy:
wGw8AECcAADAbDwAQJwAAEDDOAAAcQIA4KUBAOAuAAAA+RUAgDgBAAAuIgCAqQMAAKYOAABjLgDA+zkAQA0DAMC2BgAAcQIAwLYGAABxAgDAtgYAAHECAAAJPQAACT0AAAk9AMA3MABA0QwAAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
OE8AADhPAAAgUwAAIFMAAMhuAADIbgAAyG4AAMhuAAD4XAAA+FwAAPhcAAD4XAAA6GwAAOhsAAC40wAAuNMAANBeAwDQXgMAGCwCABgsAgDg+QIA4PkCAKg4AQDobAAAwHYAAFiYAABYmAAAWJgAAGiSAACAjgAASKgAAA==

qdat:
AAAAAAAAAAACEAAAAAAAKAgEAggAAABoQGAYAEBADEEQQSJg0AhhTFQEoFGICx8EIuR1CzXoALCsOszQAmMGbSPMZtSZGN45SSgNtmqlqLbFK8rpZSDDbOZ7F3qhTX26PWq1kHZLwOJKYCzxyi1qGC4N3D4gZQCeGgR6Dh==


formula: Ba2 P2 Al1.66 Ti.34 O10 F2
compound: <missing>
formula_title: <missing>
a: 6.977
b: 12.564
c: 5.223
alpha: 90
beta: 102.15
gamma: 90
cell_volume: 447.587
crystal_density: 4.420
atoms_sites: ["Ba", "P", "Al1", "Ti", "Al2", "O1", "O2", "O3", "O4", "O5", "F"]
atoms_x: qEkTAMCHEgAAAAAAAAAAAICEHgAQ2QwAoG0aAIBv/P/AFhAAUFYnABAuAwA=
atoms_y: 0HwSAHDtBgCAhB4AgIQeAICEHgAwpA0AcKgFACCMFwCgThsAQNUcAKD4BwA=
atoms_z: EAYcAKDD+/8AAAAAAAAAAAAAAACwuPv/4GMMACD6DQDwJAQAEFgVABAUGAA=
atoms_occupancy: AAk9AAAJPQCASCgAgMAUAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Ba", "P", "Al1", "Ti", "Al2", "O1", "O2", "O3", "O4", "O5", "F"]
atoms_aniso_u11: 8NIAAFCRAACwSQEAsEkBAMCPAACQ+wAAwAwBABCkAADQhAAAQM4AACDLAAA=
atoms_aniso_u22: MMAAABByAADgeQAA4HkAAOCSAABQqgAAoKUAAJCwAACwzAAAMPIAAJCwAAA=
atoms_aniso_u33: MFYBAPCHAACQfgAAkH4AAECcAADwBAEAEKQAABC9AAAwwAAAsJoAAAATAQA=
atoms_aniso_u12: cOX//8D5///Arv//wK7//8ASAADQIAAAMBEAANAHAAAgNQAAMFwAAADn//8=
atoms_aniso_u13: QLv//wAZAAAASwAAAEsAAPAjAACAVwAAYPD//8BEAABgVAAA8CMAAHAXAAA=
atoms_aniso_u23: 0FIAAIDz//8A5///AOf//wAZAADwCgAAwBIAAPAKAABAUQAA0DkAAKAPAAA=
pub_title:
 The crystal structure of curetonite, a complex heteropolyhedral sheet mineral
 Data has been corrected according to the ICSD

qdat:
AAAAAAAAAAAAAAAICEAAAASAAAEAAICBKIAgCCAUAxACIInEgioBJghATImCIFyCKIqhsRioIVbSdRsaq0ka33i59FTC1P+12qhbubdVvWj99qf7/vvd6ztpU+5/yfX+ojv3X55u3Xaf/Y+DcyXrP/rZ+f8/HZa/2u7/9/==


formula: Pb14 V2 Cl4 O17
compound: <missing>
pub_title: The crystal structure of kombatite, Pb14(VO4)2O9Cl4, a complex heteropolyhedral sheet mineral
formula_title: <missing>
a: 12.682
b: 22.566
c: 11.279
alpha: 90
beta: 118.11
gamma: 90
cell_volume: 2847.105
crystal_density: 7.970
atoms_occupancy: 0
atoms_aniso_label: ["Pb1", "Pb2", "Pb3", "Pb4", "Pb5", "Pb6", "Pb7"]
atoms_aniso_u11: gKIAACCyAAAg5AAAQM4AAODdAADw0gAAcJQAAA==
atoms_aniso_u22: AMgAADDyAACgvgAA0M8AANCdAACA1AAA8LkAAA==
atoms_aniso_u33: ILIAAPDSAACgvgAAoKUAAKDwAACA1AAA4N0AAA==
atoms_aniso_u12: MBEAABDc//+wHQAAgD4AABD1//8Qw///gAwAAA==
atoms_aniso_u13: oFoAABBZAABQeAAA0GsAACCAAABgbQAAcGIAAA==
atoms_aniso_u23: MN////DY//8wEQAAAOf///Dx//+Awf//sAQAAA==
atoms_sites:
["Pb1", "Pb2", "Pb3", "Pb4", "Pb5", "Pb6", "Pb7", "V", "Cl1", "Cl2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10"]

atoms_x:
AO8GAKCeFgDwwQcAQBIXANCcFQBQZwcA4GYYAABNCACAtBYAMNIWAMCGDgAgcQ8AgA0dAECcAADgUQ8AAAAAAICEHgCAhB4AgH8KAABZBgA=

atoms_y:
ECIFAMBYBQAwwBkA4HkZAMDjCwBAIgwAoIQSAOCdEwBQQR4AYNEAAEDpCABgPQgAwNkVAGBsFQCAwBQAoNkIAKDZCAAAdhYAAHwVAKAyDwA=

atoms_z:
cAcLABClBACwwBsAIMMSABBREgCwsxkAEMQDANDFCgCAqQMAYDMSAED1BgAgQRcAYLkdACC/AgBguggAQEIPAEBCDwBAQg8AAAUUAIB/CgA=

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AKCMAADAPgEAcPgAANDoAADQMwEAADIAAOBBAQBQwwAA8LkAAJDiAADAJQEAoJ8BADD5AwA=

qdat:
AAAAAAAAAIEAAAgABCGABoggAgIxlBQMBFTIG2FEAFXyuwm+TatvTs4BS/gfrJW3tX457s1W1TZs1f/lE1Hif835f5d+rb//8OvuWv91/eXXv5ffd8T+qG+up/DR6qlullbwXDkLrFYsZlgUc0ch0CMUDjIqIhAWABSkkB==


formula: Ca Na O13 B5 H8
compound: <missing>
formula_title: <missing>
a: 6.506
b: 13.280
c: 11.462
alpha: 90
beta: 92.97
gamma: 90
cell_volume: 988.983
crystal_density: 2.238
atoms_occupancy: 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
pub_title:
 Tuzlaite, NaCa[B5O8(OH)2].3H2O, a new mineral with a pentaborate sheet
 structure from the Tuzla salt mine, Bosnia and Hercegovina

atoms_sites:
["Ca", "Na", "O1", "O2", "O3", "O4", "O5", "O6", "OW7", "O-h8", "O9", "OW10", "O-h11", "O12", "OW13", "B1", "B2", "B3", "B4", "B5", "H1", "H2", "H3", "H4", "H5", "H6", "H7", "H8"]

atoms_x:
IM4MANCJFAAgQwYAEKj3/3BiGQCg6BIAUKDx/0A8KQCwOxQAUFUjAOC+AQBQWwkAMOYCAECo/v+gQyEAgPAlAIAXEwCwQPb/MIz4/wAG//9AQg8AICkbAKCWKABAfgUAQAEFAOBbNwDgCRsAQDslAA==

atoms_y:
cJo2ACASPAAglAUA8NIyAPAqAwBg5w0A0GYFAHD0OwBgvjEAEJg0AJBbPABgfisAgLwEAOCrMgAAtjUAoIACADDIBwAAaS0AcAY5AMANBQCAHi8AICgwAIAANADgLCoAIM8pAOBJOgBA4TMAIJkyAA==

atoms_z:
wAMFALCyFQCQUwMAoO0NANBnCQDgYggAYEMHACDPEABAbhAAkPUBAPBrDQAwfAMA4DckAEB58f+wJSAAQA8LAOCTBAAwcxEAMEERAFC/CQDgRREAIOIRAIAgBQCgYgcAYPD//4AZGwBAUyEAYDYeAA==

atoms_u_iso:
ELgAAAh0AQBgmgAAkOcAAAC+AACo2QAAAL4AALDbAADQLgEAkN0AAOjBAACgQAEA8CIBAIjlAACACgIAUKAAADikAAA4rgAA+LsAAGicAAAQ1QEAENUBABDVAQAQ1QEAENUBABDVAQAQ1QEAENUBAA==

qdat:
AAAAAAAAAAAAgAABQA4AkAEASoQAGFIGRUJJXFCB1tCGSYeY4tr10XDsif/1aO+a138vLezvtft7XL3fv923t/fd+L//v+99639/+///f/7v/b+bf//f4//3v3vw9u/Z95//fu3Pv7c+x8v3es/5tTP36p/R9+/fRf7+3z==


formula: Mg3.511 Ca.489 Si4 O12
compound: Synthetic
pub_title: Crystal chemistry of Ca-bearing majorite
formula_title: <missing>
a: 11.5816
b: 11.5816
c: 11.5288
alpha: 90
beta: 90
gamma: 90
cell_volume: 1546.398
crystal_density: 3.516
atoms_x: kLgHAJC4BwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAwrwcAMIgBAECQAgBAgA0AwEENAODD/P8AwPn/
atoms_y: ENYAABDWAABAQg8AQEIPAAAAAAAAAAAAQEIPAEBCDwCAcAAAwDIDACAu/f/AtgYAEOH6/5CsCQBQEQ0A
atoms_z: ALkPAAC5DwAgMiYAIDImAICEHgAAAAAAYOMWAOBnNQDwOy4Aq7AoADC0NADgbDAAIOIqABCrHAAg3S8A
atoms_occupancy: IPg3AOAQBQAgUikA4LYTAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: OKQAADikAABQswEAULMBAAhXAAAIVwAAuHQAALh0AAC4dAAAyHgAAMh4AADIeAAAyHgAAMh4AADIeAAA
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
atoms_sites:
["MgD1", "CaD1", "MgD2", "CaD2", "MgO1", "SiO2", "SiT1", "SiT2", "SiT3", "O1", "O2", "O3", "O4", "O5", "O6"]

qdat:
AAAAAAAAAAAABAAAAAgAAAQAAEAACAAAABgAYAMAGAEAEAYAAGAYBAIDgQDAAMCAwYGBBQAcKGHDChgBhxQxxBwDjHGOUUBwGOeQwHMIzmIBmUDkUDgZmIwKBM4ADkQNgBgAAgAASYAAAAAAAACQAAAAAAAAAAAAAAAAAA==


formula: Na Mg F3
compound: <missing>
formula_title: <missing>
a: 5.3603
b: 5.4884
c: 7.666
alpha: 90
beta: 90
gamma: 90
cell_volume: 225.530
crystal_density: 3.071
atoms_sites: ["Na", "Mg", "F1", "F2"]
atoms_x: MCA8AAAAAAAAXwUA4NsqAA==
atoms_y: 8MYCAICEHgBA7hwAIPsRAA==
atoms_z: QEIPAAAAAABAQg8AAO4CAA==
atoms_occupancy: 0
atoms_u_iso: QJACAECWAQCgAwIAAPQBAA==
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:
 High-pressure crystal chemistry of neighborite, NaMgF3: an angle-dispersive
 diffraction study using monochromatic synchrotron X-radiation
 P = room pressure

qdat:
AAAAAAAAAAAAAAAAAAAAAAAFAAAIAAEAACAAAASgAIAEA8AiAIBIAACAKAhJQwgQCAKUINLsAkkgIISI2kpoQiJk7QtSlBApZfOInXG5r2iKIaS33WlRm628KjQf+3duN9+WSodq29j/H924s2/53t7en32q3+29+vx5ub==


formula: Na Mg F3
compound: <missing>
formula_title: <missing>
a: 5.2386
b: 5.3796
c: 7.5052
alpha: 90
beta: 90
gamma: 90
cell_volume: 211.508
crystal_density: 3.275
atoms_sites: ["Na", "Mg", "F1", "F2"]
atoms_x: APY7AAAAAACg6wUA4MIqAA==
atoms_y: EOMCAICEHgAgoBwAoCASAA==
atoms_z: QEIPAAAAAABAQg8AIAoDAA==
atoms_occupancy: 0
atoms_u_iso: wM4CAEATAgAAcQIAYOQBAA==
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:
 High-pressure crystal chemistry of neighborite, NaMgF3: an angle-dispersive
 diffraction study using monochromatic synchrotron X-radiation
 P = 4.9 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAoAABAAAQAAIAAAAkgAIAEA6BBAIBEAABAFAIkkIIEAQCiiBJXQCSRBBAoVbWTQhESoyhpSlBAlIrrERxh21tZiRDE7s17Kc633YUTC3223oz/2UIotP/23/j+y0Pv1f9ydfjdPz9/6t/X9==


formula: Na Mg F3
compound: <missing>
formula_title: <missing>
a: 5.3609
b: 5.4828
c: 7.667
alpha: 90
beta: 90
gamma: 90
cell_volume: 225.354
crystal_density: 3.074
atoms_sites: ["Na", "Mg", "F1", "F2"]
atoms_x: QC48AAAAAAAAkQUAwAorAA==
atoms_y: YJMCAICEHgDwwBwAcPYRAA==
atoms_z: QEIPAAAAAABAQg8A8MYCAA==
atoms_occupancy: 0
atoms_u_iso: oIACAGDkAQDgIgIA4KUBAA==
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:
 High-pressure crystal chemistry of neighborite, NaMgF3: an angle-dispersive
 diffraction study using monochromatic synchrotron X-radiation
 P = room pressure following decompression

qdat:
AAAAAAAAAAAAAAAAAAAAAAAFAAAIAAEAACAAAASgAIAEA8AiAIBIAACAKAgpQwgQCAKUINHsAUkgIISI20qkQhJk7QtalAgY1PGImXGZb2iKIaSv3WlJm928ORQd+3dtF9+VRoN3y9jvj924uTXZ3bddn3v3/u+99/zY/d==


formula: (Ca.774 Na.226) Mg.901 Fe.11 Si2 O6
compound: <missing>
formula_title: <missing>
a: 9.689
b: 8.824
c: 5.280
alpha: 90
beta: 107.60
gamma: 90
cell_volume: 430.287
crystal_density: 3.341
atoms_sites: ["Ca", "Na", "Mg", "Fe1", "Si", "O1", "O2", "O3", "Fe2"]
atoms_x: AAAAAAAAAAAAAAAAAAAAANDNEQAgCwcAcHQWAOCRFQAAAAAA
atoms_y: oIoRAKCKEQAARjcAAEY3AGCaBQBATAUAoGQPAOAPAQDQmg0A
atoms_z: QEIPAEBCDwBAQg8AQEIPAOC7DgDQnwgAkFEUAICJAABAQg8A
atoms_occupancy: wD0vAEDLDQAg/jYA4AoGAAAJPQAACT0AAAk9AAAJPQDgqwAA
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegCghgEA
atoms_aniso_label: ["Ca", "Na", "Mg", "Fe1", "Si", "O1", "O2", "O3"]
atoms_aniso_u11: AEUBAABFAQAgywAAIMsAANDPAABw3wAAUKQBALDlAAA=
atoms_aniso_u22: 0PsBAND7AQCgpQAAoKUAAOCrAACgCQEAkOIAAAA/AgA=
atoms_aniso_u33: QDIBAEAyAQAg/QAAIP0AAHBDAQAQUwEA4AkCAOA7AgA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAOD8//+wHQAAYL7//4Dz//8=
atoms_aniso_u13: QB8AAEAfAABAOAAAQDgAAIBXAACQTAAAcN8AADBcAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAEDt//9g8P//AJz//5DV/v8=
pub_title:
 Low-Ca augite from experimental alkali basalt at 18 kbar: Structural variation
 near the miscibility gap
 Atomic parameters from ICSD

qdat:
AAAAAAAAAAAAAAAAIAAAAACCAAAAAgAEBAAAgIAAACIAIIEFAIARCgAAAJUgYAIQAiBxkARQhAaqIAEIOAUxFQG0TJaADCPzAyEejTOSRS+EjFjAR6P9JAyMdh9TjT0zEY69T/QsxZokPvEGo9I9ZYsorKkp1NKTR3SRYA==


formula: Na.65 Ca1.848 K.06 (Si13.554 Al4.446) O48.38 H12.38
compound: <missing>
formula_title: <missing>
a: 17.671
b: 17.875
c: 7.412
alpha: 90
beta: 116.39
gamma: 90
cell_volume: 2097.242
crystal_density: 2.183
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:
 Crystal structure and optical properties of Na- and Pb-exchanged
 heulandite-group zeolites
 Sample: nonexchanged
 Atomic parameters from ICSD

atoms_sites:
["Na1", "Ca1", "Ca2", "K", "Na2", "Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O-H11", "O-H12", "O-H13", "O-H14", "O-H15", "O-H16"]

atoms_x:
UHQJAFB0CQCg+CAAMN0QADDdEAAg8woAIPMKAGCdEQBgnREA0M0RANDNEQBg8QMAYPEDAAAAAAAAAAAAgJoSABAeDgAQMAsAkI4OAAAAAABAAQUAkMIWABCLAADw1QwAsAwHADDdEACAhB4AQM4ZAMC8BQBAAQUAAAAAAA==

atoms_y:
AAAAAAAAAAAAAAAAAAAAAAAAAAAgXQoAIF0KALB8BQCwfAUAgOUSAIDlEgCANhIAgDYSALABDQCwAQ0AAAAAAKBJBwDwagkAEIAGADDkEwCwrwkAQDwQAGA/EADggw8AMLkWAAAAAAAAAAAAkPwEAAAAAAAgTgAAEFQFAA==

atoms_z:
q7AoAKuwKABwZQwAQJwAAECcAADw5gUA8OYFAACRHgAAkR4AcEcRAHBHEQDgFRkA4BUZAAAAAAAAAAAAoFwhAEBtJQCg9zUAMJgPAICEHgAg0gMAwIMbACA+CwDw4QoAQFcYAECcAACAhB4AsN8BACBlEQDg6jQAgIQeAA==

atoms_occupancy:
gOoNAADbGgCAih0AwNQBAKDrBQCg9S0AYBMPAKD1LQBgEw8AoPUtAGATDwCg9S0AYBMPAKD1LQBgEw8AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AMCoMgAACT0AAAk9AAAJPQDAPhoAAAk9AA==

atoms_u_iso:
uN4EALjeBAAwHgIAEKcHABCnBwAoCQEAKAkBAPAYAQDwGAEAMAsBADALAQAoCQEAKAkBAAgVAQAIFQEAECoCAJhbAgAwfQIA2OQBANCgAgBgtwEAKIUCACgmAgCACgIAgAoCABCnBwBIGwYAmCwEADA0CgAgJwkA4NgPAA==

qdat:
AAAAAAAABAACAQABAABCGAAECANIIghEACg8IEUaAsRw0GzcDMWiD1XVcDG5zX2ebxfbfg3jfT+saK9vik8F71uS7mA63ObuEv9Lg1pfFWsTK7MurqHZB1aYmDzHszTZKdGl3sDGKUks3A0J4w5zdGyD/OMNwuzMKrXMsR==


formula: Na3.6 (Si13.554 Al4.446) O48.96 H10.96
compound: <missing>
formula_title: <missing>
a: 17.767
b: 17.977
c: 7.422
alpha: 90
beta: 116.14
gamma: 90
cell_volume: 2128.106
crystal_density: 2.150
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:
 Crystal structure and optical properties of Na- and Pb-exchanged
 heulandite-group zeolites
 Sample: Na-exchanged
 Atomic parameters from ICSD

atoms_sites:
["Na1", "Na2", "Na3", "Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O-H11", "O-H12", "O-H13", "O-H14", "O-H15", "O-H16", "O17"]

atoms_x:
4IgKAADpIADwUxEAwOkKAMDpCgAAexEAAHsRABC7EQAQuxEAkBsEAJAbBAAAAAAAAAAAACB4EgDQSQ4A8HcLAPAaDgAAAAAA8OwEABDPFgCQ4gAAMPUMAHBRBwDwUxEAgIQeAMDBGQBAhAQAQAEFAABlBAAAAAAA

atoms_y:
AAAAAAAAAAAAAAAAIF0KACBdCgDAcQUAwHEFAKDoEgCg6BIAIC0SACAtEgDQNg0A0DYNAAAAAABQTgcAQH8JABBOBgAgpBMAENIJAOBkEADQiBAAEGMPAPCyFgAAAAAAAAAAAOD3BAAAAAAAAAAAAOA6/v+AGgYA

atoms_z:
oA0qAODUDgAgxQEA4NgFAODYBQDQNB4A0DQeAKA/EQCgPxEAMHUZADB1GQAAAAAAAAAAAKDGIABguyUA4GE2ACA/DwCAhB4AUAIDAMBqGwBgXQsAsHELAEC1GQAgxQEAgIQeAOAiAgAAcQIAYIoQAMBDLgCAhB4A

atoms_occupancy:
ANQwAABFMwAAxAkAoPUtAGATDwCg9S0AYBMPAKD1LQBgEw8AoPUtAGATDwCg9S0AYBMPAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAAgSkAAAk9AAAJPQAALiIAAAk9AECVFgAACT0A

atoms_u_iso:
SPYHALCkBQAYcgwA2CYBANgmAQDQLgEA0C4BAMgsAQDILAEAyCwBAMgsAQCQPAEAkDwBAADbAQA4fwIAkBcDADAoAgAI8AIAADACAOCaAgDQoAIA2EMCALhPAgAYcgwAaIMKAFggCgBIyxQAaKITACAnCQBIKREA

qdat:
AAAAAAAABAACAQACAECEMAAIEAaQSBCEANB4gZI4BpGjQfKwMxWIPPdkwMbrd/x5vLa/cCeN6k9jRWt0UlglefyfYoHqqzZg69x8DPO+X9nUmTjsfQsEq2iNRNS3fatlvQ16+ATiDTOrwtkaMOZrW0RtTjFwW0nCsqB5o9==


formula: (Si13.554 Al4.446) O44.08 Pb2
compound: <missing>
formula_title: <missing>
a: 17.767
b: 17.917
c: 7.432
alpha: 90
beta: 116.33
gamma: 90
cell_volume: 2120.393
crystal_density: 2.538
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:
 Crystal structure and optical properties of Na- and Pb-exchanged
 heulandite-group zeolites
 Sample: Pb-exchanged
 Atomic parameters from ICSD

atoms_sites:
["Si1", "Al1", "Si2", "Al2", "Si3", "Al3", "Si4", "Al4", "Si5", "Al5", "Si6", "Al6", "Si7", "Al7", "Si8", "Al8", "Si9", "Al9", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "Pb1", "Pb2", "Pb3", "Pb4", "Pb5", "Pb6", "Pb7", "O20", "O21", "O22", "O23", "O24", "O25", "O26", "O27"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAAAAAABAACAQACACCCMAAIEAJQRAiEAMg4QMk0BUjhoNGYGZPIHrM0YKN1u25Y2ltdODuGtW+xor//KSgivL5LqYDtc5qwXfw+DmrtJ+hWLYy1NofENrRG4apautbKzoq9fAdRj5LU4PhOGHKdp6IXrxj0JazhZ1xKkb==


formula: V Cu13 (As1.92 Sn1.08) S16
compound: <missing>
formula_title: <missing>
a: 10.621
b: 10.621
c: 10.621
alpha: 90
beta: 90
gamma: 90
cell_volume: 1198.109
crystal_density: 4.607
atoms_sites: ["V", "Cu1", "Cu2", "Cu3", "As", "Sn", "S1", "S2"]
atoms_x: AAAAAKCvDwBwOg8AQEIPAEBCDwBAQg8AgEYHAICbFgA=
atoms_y: AAAAAAAAAABwOg8AAAAAAICEHgCAhB4AgEYHAGDKFgA=
atoms_z: AAAAAAAAAABwOg8AgIQeAAAAAAAAAAAAgEYHAEByBwA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAQJwAA+RUAAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["V", "Cu1", "Cu2", "Cu3", "As", "Sn", "S1", "S2"]
atoms_aniso_u11: AJYAAMDBAACAnAEAAK8AAFAOAQBQDgEAoCIBAMDaAAA=
atoms_aniso_u22: AJYAAIDtAACAnAEAUL0BACBnAAAgZwAAoCIBAFBfAAA=
atoms_aniso_u33: AJYAAJCRAQCAnAEAUL0BACBnAAAgZwAAoCIBAHBDAQA=
atoms_aniso_u12: AAAAAAAAAADAEgAAAAAAAAAAAAAAAAAAkOj//8Dg//8=
atoms_aniso_u13: AAAAAAAAAADAEgAAAAAAAAAAAAAAAAAAkOj//5ABAAA=
atoms_aniso_u23: AAAAACBOAADAEgAAAAAAAAAAAAAAAAAAkOj//8D5//8=
pub_title:
 New occurrences and refined crystal chemistry of colusite, with comparisons to
 arsenosulvanite
 Sample: Sn-rich, crystal 2

qdat:
AAAAAAAAAAAAAAgAAAACAAgAQAABAAAQAAQEBAAECBAAQQIAIIIAAQgBAEAQhAIRAIRAICAREBAgAiBEgJECRAkQSIJIEkAkCSESEkEoBISQggSElKQhCkKQJEIAgUShEKgEKgAEiIJEBEABAgAAREAEAAIAAAACQAAAAA==


formula: V Cu11.94 As3 S16
compound: <missing>
formula_title: <missing>
a: 10.538
b: 10.538
c: 10.538
alpha: 90
beta: 90
gamma: 90
cell_volume: 1170.239
crystal_density: 4.392
atoms_sites: ["V", "Cu1", "Cu2", "Cu3", "As", "S1", "S2"]
atoms_x: AAAAAADSDwCQVg8AQEIPAEBCDwAQYQcA8E4WAA==
atoms_y: AAAAAAAAAACQVg8AAAAAAICEHgAQYQcA4NYWAA==
atoms_z: AAAAAAAAAACQVg8AgIQeAAAAAAAQYQcAgF8HAA==
atoms_occupancy: AAk9AAAJPQBg3CwAAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: 0
atoms_aniso_label: ["V", "Cu1", "Cu2", "Cu3", "As", "S1", "S2"]
atoms_aniso_u11: cHsAAIDUAAAgLwEAYJkBAABkAACAiQAA4L4BAA==
atoms_aniso_u22: cHsAAEBkAQAgLwEAUKQBAFB4AACAiQAAoIwAAA==
atoms_aniso_u33: cHsAAHAqAQAgLwEAUKQBAFB4AACAiQAAAOEAAA==
atoms_aniso_u12: AAAAAAAAAADAEgAAAAAAAAAAAADA+f//kGUAAA==
atoms_aniso_u13: AAAAAAAAAADAEgAAAAAAAAAAAADA+f//cJr//w==
atoms_aniso_u23: AAAAAJC2///AEgAAAAAAAAAAAADA+f//gPP//w==
pub_title:
 New occurrences and refined crystal chemistry of colusite, with comparisons to
 arsenosulvanite
 Sample: Sn-poor, crystal 1

qdat:
AAAAAAAAAAAAAAgAAAABAAQAIAAAQAAEAAEBAQACAgQAEECACCCAAEEAQAgCEIBCIAiIBAQCIgICACIESAkQJEiRBEkiQSJBIJIJIJIJQCUkhBAUFKUhCUkKgKEKAgUKhEKgEKQAChIFEAkAAgQAAIiACAACAAAABEAAAA==


formula: Al2.826 Si.174 O4.588
compound: <missing>
pub_title: Crystal structure of Al-rich mullite
formula_title: <missing>
a: 7.7391
b: 7.6108
c: 2.9180
alpha: 90
beta: 90
gamma: 90
cell_volume: 171.872
crystal_density: 2.986
atoms_sites: ["Al", "AlT", "SiT", "Al*", "Al**", "Oab", "Oc", "Od"]
atoms_x: AAAAAPAGCQDwBgkA4M4PAGByFACwmRUAwK8cAIAnCAA=
atoms_y: AAAAANA+FADQPhQAMHINAGBJBgCQsBkAgLUBAEA1DQA=
atoms_z: AAAAAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAAAAAAA=
atoms_occupancy: AAk9AICEHgBgTwUAwPERAGBDBwAACT0AwPERAAAJPQA=
atoms_u_iso: 4H0BALgfAAC4HwAA6GIAAMBRAgDwdwEAGD8DAOg9AgA=
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:
AAAAAAAAAAAAAAAAAAAIAAAAAAAkAAKAAAABAACABABEAwAwAoAACAQhKBAADoAAAiIgYgUiAgoADxhRAccCgSB0CBkkxAqCEJTSoAYqEoPGIcVzK4pJ2qNCVeuzFDjPuTqpWWR+6PtDz6zGv2y5jToHa7tz4U/9om1z/n==


formula: Na2 Mn11 Mg5 As2 Si12 O50 H8
compound: <missing>
pub_title: Johninnesite: Crystal-structure determination and its relationship to other arsenosilicates
formula_title: <missing>
a: 10.485
b: 11.065
c: 9.654
alpha: 107.11
beta: 81.17
gamma: 111.86
cell_volume: 992.263
crystal_density: 3.459
atoms_occupancy: 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
atoms_sites:
["Na", "Mn1", "Mn2", "Mn3", "Mn4", "Mn5", "Mn6", "Mg1", "Mg2", "Mg3", "As", "Si1", "Si2", "Si3", "Si4", "Si5", "Si6", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "O20", "O21", "O-H1", "O-H2", "O-H3", "O-H4"]

atoms_x:

atoms_y:

atoms_z:

atoms_u_iso:

qdat:
AAAAAAAAAAFIAAAIAMAAAUiBCAFkAAsiIChoJIUMSAQUtFWzAIDNXTdQlMYnqnqN+l6XXztPPfzrdbr/d/rrty9v3vv+d5e+er/9/3u/8v//77//9bv/7///7W////Hr7ze0/t+O//v+7uv7/u//++/Tv/3/32/56/3shd==


formula: As2 Fe2.38 Ti.58 O7
compound: Lengenbach quarry, Binnatal, Switzerland
formula_title: <missing>
a: 10.616
b: 3.242
c: 8.932
alpha: 90
beta: 108.89
gamma: 90
cell_volume: 290.857
crystal_density: 4.825
atoms_sites: ["As1", "As2", "Fe1", "Fe2", "Fe", "Ti", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8"]
atoms_x: 0AcZABA7DwCA/wIAwDsnALjfNQC43zUAAPsEAPAPFABAzjIAgJg8AHB1GgAwUw4AMGcsAOCtIQA=
atoms_y: QEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwA=
atoms_z: SI8oAIAlDwDA4jQAiF0BAGAFGABgBRgA8BIHAMBSBgAgrgkAAMslACA8NQBgjyQAMEcpAKBmFwA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AIAxFwCAZiMAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AgIQeAICEHgA=
atoms_u_iso: 0
atoms_aniso_label: ["As1", "As2", "Fe1", "Fe2", "Fe", "Ti", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8"]
atoms_aniso_u11: 4JIAANCdAACwswAAAH0AAHAqAQBwKgEAQJwAACBIAQCQfgAAQJwAACCAAABAnAAAIEgBAIC1AQA=
atoms_aniso_u22: UKoAAKClAADQnQAA8IcAAADhAAAA4QAAwFcBACBIAQCAOAEA4J8CAOClAQAgswQAYOoAAAB3AQA=
atoms_aniso_u33: 0J0AACCyAACwzAAAMKcAABC9AAAQvQAAgDgBACAvAQDgkgAAQJwAAPCgAABg6gAAwNoAAECWAQA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: GDgAAABBAABQRgAAcDAAAGAiAABgIgAAMCoAAPDSAACgDwAA0CAAABAnAAAgNQAAIE4AAMDaAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
pub_title:
 Fetiasite (Fe2+,Fe3+,Ti)3O2[As2O5], a new arsenite mineral: Its description
 and structure determination
 Note: Sample B

qdat:
AAAAAAAAAAEAIAAAAACABAAABAAEABAIAAiAAYEACCIAghAQQMAATBAhgYgSAIlBWFiNARYXQ0sgBBsRi0GsZYKA1FKstloUYmGSjfAjVmbTz4pPmTvo8PY/0MbTaSmfl793WqVryXaK9682M5azlxfjyJa3p5a6u13p23==


formula: As2 Fe2.38 Ti.54 O7
compound: Cervandone
formula_title: <missing>
a: 10.614
b: 3.252
c: 8.945
alpha: 90
beta: 108.95
gamma: 90
cell_volume: 292.018
crystal_density: 4.784
atoms_sites: ["As1", "As2", "Fe1", "Fe2", "Fe", "Ti", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8"]
atoms_x: kAEZANA+DwAQAQMAqDUnAAjlNQAI5TUAcPkEAMAXFAAgyzIAoJs8AMBwGgDAVA4AcG0sAACxIQA=
atoms_y: QEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwA=
atoms_z: kJIoAIgiDwDA4jQAmFcBALgHGAC4BxgAQA4HADBRBgBQpgkAkMwlAGBCNQAQlCQAkFApALBbFwA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AIAxFwCA9SAAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AgIQeAICEHgA=
atoms_u_iso: 0
atoms_aniso_label: ["As1", "As2", "Fe1", "Fe2", "Fe", "Ti", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8"]
atoms_aniso_u11: gIkAAFCRAACQsAAAgHAAAOAPAQDgDwEAAH0AAIA4AQCgjAAAQJwAAIC7AAAgywAAYGcBAKADAgA=
atoms_aniso_u22: cJQAAECcAABgnwAAQIMAAHD4AABw+AAAAHcBAGBnAQDAVwEAYN4CAOClAQDgjQUAgLsAAECWAQA=
atoms_aniso_u33: gIkAAICiAAAwwAAAAJYAAEC1AABAtQAAQBkBAKAJAQCgjAAAoIwAAKCMAADA2gAAoAkBAIA4AQA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: MCoAAAAyAADwPAAA0CAAAAAZAAAAGQAAAAAAAECcAAAAAAAAABkAAHAwAABAHwAAIE4AAAB9AAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
pub_title:
 Fetiasite (Fe2+,Fe3+,Ti)3O2[As2O5], a new arsenite mineral: Its description
 and structure determination
 Note: Sample A

qdat:
AAAAAAAAAAEAIAAAAACABAAABAAEABAIABEAAQIACCIBBBAQQUAASBAhgZAiAJCCcTijAhonQ0ogBBohowHMqQKBNNM0upkUY8PrH9BGfabHm1ybIXPRwrQ/0drVYdk2/V1200Rdqe4k5+57f0trzRtHS/lzRkr5rMfN1d==


formula: I6 O48 S6 K3.56 Na4.44 Mg5 H12
compound: <missing>
formula_title: <missing>
a: 9.4643
b: 9.4643
c: 27.336
alpha: 90
beta: 90
gamma: 120
cell_volume: 2120.521
crystal_density: 3.284
atoms_x: ANQXAODmCwBA6B0AoFsdAABvEwAAlBEAgG0NAICEHgBAuRAAUCAXAAAAAAAAAAAAVVgUAAAAAABVWBQAVVgUAAAAAADgtSgA
atoms_y: oIkNAOAiAgBgtAkAoFAKAKA5EgAAZBkAYD0IAECbFQBgARIAAAAAAAAAAAAAAAAAq7AoAAAAAACrsCgAq7AoAAAAAAAAwx4A
atoms_z: 8MYbAFDQGwAQwxgAUAkfAFDOEwAAQxIAQJQSAMCaEwBQORcAQEIPAGCOBwBgjgcAgFwUAEBCDwAggggA4FQbAAAAAADAOQYA
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AADyKwAAFxEAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: gFcAABC9AAAQvQAAEAgBAECcAAAQvQAAAJABAJBfAQAA4QAAkF8BABA0AgAQNAIAQDIBABC9AAAA4QAAAOEAAJBMAAAAGQAA
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:
 Mineralogical studies of the nitrate deposits of Chile: VII. Two saline
 minerals with the composition K6(Na,K)4Na6Mg10(XO4)12(IO3)12.12H2O:
 Fuenzalidaite (X=S) and carloruizite (X=Se)

atoms_sites:
["I", "O1", "O2", "O3", "S", "O4", "O5", "O6", "O7", "K1", "Na", "K", "Na1", "Na2", "Mg1", "Mg2", "Mg3", "Wat8"]

qdat:
AAAAAAACAAAABABIAAAAgAUkAkKgAJCBARrCARJRJoAQeizEcRA3AJQLxGHisDBFIGtP0oxWjSXBinUxzw0lU2jAndXEdOkhm6IR028ZvSrQo1TusvV3ibSpQx5dzL7qinWuHvTarR7k1EOa59tN8yXtYhEvS22TqTEIgA==


formula: I6 O48 Se6 K3.64 Na4.36 Mg5 H12
compound: <missing>
formula_title: <missing>
a: 9.5901
b: 9.5901
c: 27.56
alpha: 90
beta: 90
gamma: 120
cell_volume: 2195.109
crystal_density: 3.600
atoms_x: 8N4XAKBEDACg2B0AQGsdAEB1EwDAdBEAYJwNAODxHgBAuRAAoGYXAAAAAAAAAAAAVVgUAAAAAABVWBQAVVgUAAAAAADAZygA
atoms_y: 8GsNAGBhAgAAQQoAwJ4KAABDEgDgDxoAwLAHACBHFgDA8REAAAAAAAAAAAAAAAAAq7AoAAAAAACrsCgAq7AoAAAAAACgVR4A
atoms_z: ANUbABD8GwCQARkAQOIeADDLEwBwKBIA8H8SAECOEwAQMxcAQEIPAMBlBwDAZQcAoF8UAEBCDwBwfQgAAFgbAAAAAAAwBgYA
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AACBKQAAiBMAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 4KsAAECcAAAQCAEAQDIBABC9AABAMgEAEL0AAEAyAQBAMgEAkMMBAJBfAQCQXwEAkF8BABC9AAAA4QAAAOEAABAIAQBAMgEA
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:
 Mineralogical studies of the nitrate deposits of Chile: VII. Two saline
 minerals with the composition K6(Na,K)4Na6Mg10(XO4)12(IO3)12.12H2O:
 Fuenzalidaite (X=S) and carlosruizite (X=Se)

atoms_sites:
["I", "O1", "O2", "O3", "Se", "O4", "O5", "O6", "O7", "K1", "Na", "K", "Na1", "Na2", "Mg1", "Mg2", "Mg3", "Wat8"]

qdat:
AAAAAAACAAAACACQAAACABRQCQqAAkIEBM4ICFsEtACDYWZDkIFwCSCsRhZWBgR2DOn6UY+RSLAin0z1w0m0rDBOasI6VLCVUxFS7Rm9auEjrd1l6+sXcVMGNTcye6Yp1Li3Vu1YvxZiPO97svaZXdIiFb07aWyVIQgAt2==


formula: Fe Si O3
compound: <missing>
formula_title: <missing>
a: 9.7075
b: 9.0807
c: 5.2347
alpha: 90
beta: 108.46
gamma: 90
cell_volume: 437.700
crystal_density: 4.004
atoms_sites: ["Fe1", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_x: AFUPAADFDQBgxQIAMMIhAGApNQDgIRcAIKEHAKCiJgBAeAYAABwlAA==
atoms_y: oOcnAJDiAACApxQA4N0yAEChFAAgFjMAAEYeACDgOwBAPBAAwNgqAA==
atoms_z: YM4NAHCqDQCwyhEAcNYOAEDdCgCgXAgAYHIUAOCeFwAgcCQAwK8cAA==
atoms_occupancy: 0
atoms_u_iso: CLYAAJjfAAC4fgAAWJgAAKh6AAC4dAAAmIoAAJDnAADgHgEAkDwBAA==
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:
 The structure of high-pressure C2/c ferrosilite and crystal chemistry of
 high-pressure C2/c pyroxenes
 P = room pressure

qdat:
AAAAAAAAAAAIAAAAQAAAAACggGAAAIAQIAQEkIAAEYYDAERkmCCkIFEQB4rAEIkSrDUtSQU09ULgkZJSNmrHrSBHysR3q3j4z4ZJ8V91Hu57oba3+b9b/t9D3/vv23f9/fP1nz79n/tlb0/xc9P5lXzvvvfH7/+R0z3ruY==


formula: Fe Si O3
compound: <missing>
formula_title: <missing>
a: 9.540
b: 8.996
c: 5.008
alpha: 90
beta: 103.01
gamma: 90
cell_volume: 418.763
crystal_density: 4.185
atoms_sites: ["Fe1", "Fe2", "Si", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAADAPBIAwLAHAKACFwAAfBUA
atoms_y: 4EI3AJCbEAAgYgUAYMwFAKA4DgAgPAMA
atoms_z: QEIPAEBCDwCQlA0AQGYJACDEFgDAATkA
atoms_occupancy: 0
atoms_u_iso: KEsAAHg3AADYCQAAYDsAAGA7AABgOwAA
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:
 The structure of high-pressure C2/c ferrosilite and crystal chemistry of
 high-pressure C2/c pyroxenes
 P = 1.87 GPa

qdat:
AAAAAAAAAAAAAAAAQAAAAAEIAAAABAACIAACCAAAAEAhAkEATACKBAAAQHJIAEAJBCIMFDIMDsCAMBBmgg4RAHMlatRAEUgvIa0ahMlEksozwhSwTaj5Lh+rTHBSXAHt5OjY8iSOM/K2D0iO+nXOAYDG6nEiS4rogC0rEj==


formula: Fe Si O3
compound: <missing>
formula_title: <missing>
a: 9.73
b: 9.11
c: 5.23
alpha: 90
beta: 107.8
gamma: 90
cell_volume: 441.396
crystal_density: 3.971
atoms_sites: ["Fe1", "Fe2", "Si", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAAAAERIAgJEHAGDjFgBg6RUA
atoms_y: IP42AGANEAAgMAUAQH4FAACmDgBg5AEA
atoms_z: QEIPAEBCDwCAYQ8AYLQJAEAYFgAgvwIA
atoms_occupancy: 0
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
pub_title:
 The structure of high-pressure C2/c ferrosilite and crystal chemistry of
 high-pressure C2/c pyroxenes
 Sample: fictive hedenbergite-like C2/c FeSiO3 phase

qdat:
AAAAAAAAAAAAAAAAQAAAAACgAAAAAQAQQAABIAAAAAwCAQkBYAGQAEAACC0AgAKIEASRIgECygUCBEgArwkARAMcGkkgw8KBKJOIG8OIQqpuJlDFF2N7dVAZ8Aq8TJZaPmP0UsTmqAYHTyVr9mXQewZmkmUyYsIHZz0SFA==


formula: Al Si3 Na O8
compound: <missing>
formula_title: <missing>
a: 8.1372
b: 12.787
c: 7.1574
alpha: 94.245
beta: 116.605
gamma: 87.809
cell_volume: 664.037
crystal_density: 2.623
atoms_x: mIoAAPg5AABoNioAsJkpABhfEAC4UQAA0B8kACCaMQCIDjIAQMkAAChtAQBonwwAeDsLAA==
atoms_y: eEYKADARMgDguQYAgNE1ANBhPAAQAQgA6No8ALCyBgCQ8DMAuGwSALhUKgA4qAYAIPs0AA==
atoms_z: CLkMADh4DgA4NxMAQP8VAPjqCACICjsAQB0RAOinCwDAxg8A+IgQAMj3DQD4vRcAgJwaAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_u11: 2IsAABiIAAAofQAAgHUAAID3AAAQKwEAiJUAANDoAADA8wAA0M8AAOC/AABo4gAAyP8AAA==
atoms_aniso_u22: 8IIAAHh4AAB4aQAA8G4AACA8AwAo0gAAwIAAAGDlAAA4KwEAsJUAADiLAADI3AAAKPAAAA==
atoms_aniso_u33: iHwAAABpAADQjgAA+I4AABAgAgDgnAAA+MAAAMAWAQD4agEA6P0AAHAHAQDImwAAUKUAAA==
atoms_aniso_u12: uO3//wAUAAAoAAAAIAgAAAC///8g/v//OPr//yDR//9YQwAAqOn//+AfAACoJQAAcNv//w==
atoms_aniso_u13: MEMAAFg5AADwNwAAgDkAALCVAACIfAAASDUAAHCeAAAw1AAAGGUAAAhDAADAJgAAyA8AAA==
atoms_aniso_u23: UAUAAIAMAACQCwAAuBAAAKB6/v84IgAAcBwAAIjr///AEgAAEP///9AWAADIGQAAsPX//w==
pub_title:
 The high-pressure crystal chemistry of low albite and the origin of the
 pressure dependency of Al-Si ordering
 P = 0, complete data set
 Note: sample is from Crete

atoms_sites:
["Al", "Si1m", "Si2o", "Si2m", "Na", "O(A1)", "O(A2)", "O(B)o", "O(B)m", "O(C)o", "O(C)m", "O(D)o", "O(D)m"]

atoms_aniso_label:
["Al", "Si1m", "Si2o", "Si2m", "Na", "O(A1)", "O(A2)", "O(B)o", "O(B)m", "O(C)o", "O(C)m", "O(D)o", "O(D)m"]

qdat:
AAAAAAAAQAAAAAIAMABAABAAiAQBFBEEBgIBCDAggoPVAQUBAcoMLIwMK+abJAFMxL2ZiB0XqXUbgau8qx+4PtL5Ir9P9Wp9o3Y61hlmPX7Z/nKzVv3f7uX/u/zf/7lP8vd2/17v3ffv5vX/79c/feN7z82f8/vV8/963/==


formula: Na Al Si3 O8
compound: <missing>
formula_title: <missing>
a: 8.1372
b: 12.7870
c: 7.1574
alpha: 94.245
beta: 116.605
gamma: 87.809
cell_volume: 664.037
crystal_density: 2.623
atoms_x: KG0QABCLAAAwPgAA8D8qAFCaKQAYYAAAcBskABCqMQCQ/DEAmMEAAJhrAQB4mQwA4AoLAA==
atoms_y: wF08APhDCgA4EzIAoL0GAPjRNQAwCQgAENs8AHi4BgAo7zMAaGwSAGBSKgAwpgYAqPo0AA==
atoms_z: MBcJABCsDACocQ4AyEcTAMAGFgDoIjsAwAYRAIDnCwCIpA8ASGsQAFDjDQAYlBcAgCkaAA==
atoms_occupancy: 0
atoms_u_iso: wFECALh+AACwfAAAuHQAAMh4AACQ5wAAWJgAANDPAAB46wAAAL4AAAi2AAB46wAAAB0BAA==
atoms_aniso_label: ["Na"]
atoms_aniso_u11: CBUBAA==
atoms_aniso_u22: 6DwDAA==
atoms_aniso_u33: aEUCAA==
atoms_aniso_u12: YLT//w==
atoms_aniso_u13: eL4AAA==
atoms_aniso_u23: cIL+/w==
pub_title:
 The high-pressure crystal chemistry of low albite and the origin of the
 pressure dependency of Al-Si ordering
 P = 0, constrained data set
 Note: sample is from Crete

atoms_sites:
["Na", "Al1o", "Si1m", "Si2o", "Si2m", "O(A1)", "O(A2)", "O(B)o", "O(B)m", "O(C)o", "O(C)m", "O(D)o", "O(D)m"]

qdat:
AAAAAAAAQAAAAAIAMABAABAAiAQBFBEEBgIBCDAggoPVAQUBAcoMLIwMK+abJAFMxL2ZiB0XqXUbiau8qx+4PtL5Ir9P9Wp9o3Y61hlmPX7Z/nKzVv3f7uX/u/zf/7lP8vd2/17v3ffv5vX/79c/feN7z82f8/vV8/963/==


formula: Na Al Si3 O8
compound: <missing>
formula_title: <missing>
a: 8.1104
b: 12.7710
c: 7.1482
alpha: 94.244
beta: 116.667
gamma: 87.835
cell_volume: 659.817
crystal_density: 2.640
atoms_x: GDwQABCGAAB4MgAAODQqANiPKQCwaAAA0PwjAECOMQBg+jEAkKYAAGh9AQCwZgwAMMoKAA==
atoms_y: SGc8AOBCCgA4EzIA0LUGAPjRNQBgBggASN88ACipBgAI8TMAKGYSABBcKgDwnwYAEOg0AA==
atoms_z: 2JwIACi8DAA4bg4AQEgTAHgrFgCYIjsAyA0RAECvCwCopw8AeHcQACA7DgBADRcAaM4ZAA==
atoms_occupancy: 0
atoms_u_iso: WMgCAKCCAACYgAAA2HIAANhyAACo2QAAgI4AAPDDAABw6QAAKKoAAODJAABY9wAA8BgBAA==
atoms_aniso_label: ["Na"]
atoms_aniso_u11: oAkBAA==
atoms_aniso_u22: qCcDAA==
atoms_aniso_u33: MOUDAA==
atoms_aniso_u12: SJX//w==
atoms_aniso_u13: sCEBAA==
atoms_aniso_u23: WEr+/w==
pub_title:
 The high-pressure crystal chemistry of low albite and the origin of the
 pressure dependency of Al-Si ordering
 P = .44 GPa
 Note: sample is from Crete

atoms_sites:
["Na", "Al1o", "Si1m", "Si2o", "Si2m", "O(A1)", "O(A2)", "O(B)o", "O(B)m", "O(C)o", "O(C)m", "O(D)o", "O(D)m"]

qdat:
AAAAAAAAQAAAAAEAGABAABAAiAIBFAkEBQIBCDAQQYNOgYKAgbUKFkYGF9bKpgCmYn7NTg5HvNxJ5M/eM83uH+m+SU+39XaXyX8ev8rZ33+239ztOz91+Z5/tu/7/+5x5L//+/79+399fO06//3vlbzO2fFz/O/9/n/V8/==


formula: Na Al Si3 O8
compound: <missing>
formula_title: <missing>
a: 8.0510
b: 12.7336
c: 7.1242
alpha: 94.252
beta: 116.784
gamma: 87.909
cell_volume: 650.203
crystal_density: 2.679
atoms_x: IBsQAFhwAABwHAAA8CsqAFBKKQDAXQAAoLQjALBzMQDYuTEAKIIAAKBPAQBI2AwAYKQKAA==
atoms_y: 2Hc8APg5CgDwGTIAqLAGALDJNQDQ/wcA2NE8AMB/BgBA5jMAgF4SAABdKgDQpgYACOY0AA==
atoms_z: WKkIABifDADIag4AQFcTAKD5FQCANTsA2OQQAAiDCwCYSQ8AeKQQAGjuDQBA3xcAgNQZAA==
atoms_occupancy: 0
atoms_u_iso: GD8DANBwAADgagAA+GYAAMhuAAAQuAAAAF8AANDPAABQ9QAAKKoAADiuAADA1QAAABMBAA==
atoms_aniso_label: ["Na"]
atoms_aniso_u11: iHYBAA==
atoms_aniso_u22: KN8CAA==
atoms_aniso_u33: IAIGAA==
atoms_aniso_u12: YM3//w==
atoms_aniso_u13: kF4CAA==
atoms_aniso_u23: gMz+/w==
pub_title:
 The high-pressure crystal chemistry of low albite and the origin of the
 pressure dependency of Al-Si ordering
 P = 1.22 GPa
 Note: sample is from Crete

atoms_sites:
["Na", "Al1o", "Si1m", "Si2o", "Si2m", "O(A1)", "O(A2)", "O(B)o", "O(B)m", "O(C)o", "O(C)m", "O(D)o", "O(D)m"]

qdat:
AAAAAAAAQAAAAAEAGABAAAgAiAEAiQKCAkEAhBQEESFykMCgQFWEgxuAiuNsmwAVkE9t6kHI7baKNil3wjUex21fqplht57R+Gb7tftfndvVv/7K8ePXP7Xj9/+N5//vkpZ//+/9zb7/7/Fd73/+3239zV/rfv/v5r9O/v==


formula: Na Al Si3 O8
compound: <missing>
formula_title: <missing>
a: 7.9567
b: 12.6784
c: 7.0897
alpha: 94.217
beta: 116.992
gamma: 88.025
cell_volume: 635.564
crystal_density: 2.740
atoms_x: kMkPAKBaAAAY/P//2PMpAGD+KADocQAAmHYjACBPMQBAiTEAcPT//xgtAQBw5wwAOOAKAA==
atoms_y: yJs8ACgoCgDgFTIAsJ4GAJi5NQA44wcA6NA8ACA5BgCI1TMAyFISAEBUKgBwuwYAEPw0AA==
atoms_z: YH4IAOCaDADoaA4AKAETAKj2FQBADDsAqDwRAGA6CwDYkA8A+JwQALCrDQDwkxcAeDEaAA==
atoms_occupancy: 0
atoms_u_iso: CPACAMB2AADgagAACGEAAABfAAAgsgAAiIYAAPDDAABA+wAAOK4AAGCaAABABQEAsDoBAA==
atoms_aniso_label: ["Na"]
atoms_aniso_u11: qJwBAA==
atoms_aniso_u22: QF4CAA==
atoms_aniso_u33: qEgFAA==
atoms_aniso_u12: yPb//w==
atoms_aniso_u13: sDQCAA==
atoms_aniso_u23: WOr+/w==
pub_title:
 The high-pressure crystal chemistry of low albite and the origin of the
 pressure dependency of Al-Si ordering
 P = 2.68 GPa
 Note: sample is from Crete

qdat:
AAAAAAAAIAAAAABACgAgAAQARABAJEDAgRBAIQ0BAohKoigMIDRhEFHICZojGeABtgfXXsEUX5sq49NLcij0/mXVzkX7p3L1RvJfvP4uPp/zs/f/8K/V9zcL35n/F5175dt0//79/3b/Z/+T8s9fXe/ev8c3/mj/2z790/==


formula: Na Al Si3 O8
compound: <missing>
formula_title: <missing>
a: 7.8925
b: 12.6400
c: 7.0667
alpha: 94.177
beta: 117.074
gamma: 88.128
cell_volume: 626.063
crystal_density: 2.782
atoms_x: eNcPAJg/AAAg0f//KMcpADCiKADwkQAAmEQjACBPMQCIKDEAgJn///AEAQAg9gwAQM4KAA==
atoms_y: GKs8AGAdCgAgEjIAOIoGAEiqNQDwxgcAgMo8AHgTBgCgxzMAKEMSACBRKgDg0gYAYBA1AA==
atoms_z: 2OwIAAiMDADQWA4AwMMSAGCyFQDgGzsA+B4RABhQCwCQTA8A2IAQADCQDQAwqRcAWH4aAA==
atoms_occupancy: 0
atoms_u_iso: ANsBAKh6AADAdgAA0HAAANhoAABIqAAAGFsAAMjNAAA4AwEASKgAADCsAADA1QAAKAkBAA==
atoms_aniso_label: ["Na"]
atoms_aniso_u11: wOQAAA==
atoms_aniso_u22: gEsCAA==
atoms_aniso_u33: GEUCAA==
atoms_aniso_u12: WMv//w==
atoms_aniso_u13: WMUAAA==
atoms_aniso_u23: kJ7+/w==
pub_title:
 The high-pressure crystal chemistry of low albite and the origin of the
 pressure dependency of Al-Si ordering
 P = 3.78 GPa
 Note: sample is from Crete

qdat:
AAAAAAAAIAAAAABACgAQAAIAIgAgEhBgQYRAEERAQMJGyFQDCB0QhHJyA66K5lAAPoHlTtAijOPidLHR/0S9vPj9KLx+7Ks/eb3D9tPJ7im/OX9vp4/ni238O96f8o9f/dOV6/b+nf7u5c/afde/f+993fv7Xf9P//R+89==


formula: (Ti.9 Zr.1) Si4 Na2 O13 H4
compound: <missing>
formula_title: <missing>
a: 16.3721
b: 8.7492
c: 7.4020
alpha: 90
beta: 90
gamma: 90
cell_volume: 1060.283
crystal_density: 2.647
atoms_sites: ["Ti", "Zr", "Si1", "Si2", "Na", "O1", "O2", "O3", "O4", "O5", "O6", "OW", "H1", "H2"]
atoms_x: AAAAAAAAAAAQCQUAcJAJAHA+BgBwwgkA0A4DAKBzAACgFwcAMM4GAEBCDwAg7QsAII8KAEDFDgA=
atoms_y: gIQeAICEHgBQ2AkAcNkaAHAuKgBA8Q8AQEUCAACBEAAwGAMAIOwgAICEHgDAxSkAQMQjAECsJwA=
atoms_z: AAAAAAAAAABwnAcAMOMPAMD2JQBgPgwA8HIQABDdAwAwoP3/wGsGAJCCEABAjfb/gGj5/wDX8f8=
atoms_occupancy: gO42AIAaBgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: YOQBAGDkAQCA5wEAkPsAAGDYAwCghgEAgLUBAKCGAQCgAwIAIEgBAAD6AACg/QIAgBoGAICLCAA=
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:
 Penkvilksite, a new kind of silicate structure: OD character, X-ray
 single-crystal (1M), and powder Rietveld (2O) refinements of two MDO polytypes
 Note: polytype 2O

qdat:
AAAAAAAAAAAABEAAAAACAAGAgCCRMgCqAJQgUjYQiCKQMw4Pm040KsMj0o9bU9xw843tfqiv1Xe782ulqfDu9f63aeX/v37j//rd/v267//x79+f/69X+/X////3//V+//95/23f29u+Z/23vv///vdfr7X/Ner/rvFMn3==


formula: Ti Si4 Na2 O13 H4
compound: <missing>
formula_title: <missing>
a: 8.956
b: 8.727
c: 7.387
alpha: 90
beta: 112.74
gamma: 90
cell_volume: 532.482
crystal_density: 2.608
atoms_sites: ["Ti", "Si1", "Si2", "Na", "O1", "O2", "O3", "O4", "O5", "O6", "OW", "H1", "H2"]
atoms_x: AAAAAODACQAgJxMAgMQLAAAkEwCATAYAcEMBADBTDgAwwwwAgIQeAACPFgBAJBQAAMkdAA==
atoms_y: gIQeAHDCCQDw/hoAADAqAFD/DwAwUAIAUPkQAPAqAwAw4SAAAAAAAIAKKgAg7SQA4LUoAA==
atoms_z: AAAAAFAXDACw0hgAAI4rAGAhFQAgixMA0CEEAABMBAAQJA0AAAAAAOC+AQAgrQUAQAcEAA==
atoms_occupancy: 0
atoms_u_iso: gHAAAJB+AAAggAAAoJ8BAMDBAABguAAA8LkAAODEAABQqgAA4N0AALDAAgBAYAoAQGAKAA==
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:
 Penkvilksite, a new kind of silicate structure: OD character, X-ray
 single-crystal (1M), and powder Rietveld (2O) refinements of two MDO polytypes
 Note: polytype 1M
 Data has been corrected according to the ICSD

qdat:
AAAAAAAAAAAACAAAAEAEAAAAgIIQkACAAkAgIEw5ABAgkgBKoDKA6KIAQmGiBdycMQmpGTF2hSTi8rtHEcC3ztiZak3Y/zbN3VX8Pl693ZHf+92xe//+P/2v+3/1L7/992u/+/7O//t/bn+3+nedd/v/3v/y6X38L/ayd3==


formula: Si2 Mg3 O9 H4
compound: <missing>
formula_title: <missing>
a: 5.330
b: 5.330
c: 7.269
alpha: 90
beta: 90
gamma: 120
cell_volume: 178.838
crystal_density: 2.573
atoms_sites: ["Si", "Mg", "O1", "O2", "O3", "O4", "H1", "H2"]
atoms_x: VVgUAMBJFABVWBQAMO0eACCjKAAAAAAAgEgoAAAAAAA=
atoms_y: q7AoAAAAAACrsCgAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_z: AEwEAECQGwCA0hEAkFL//2DHIwDgPxIAwFUrAAA1DAA=
atoms_occupancy: 0
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAQA0DAEANAwA=
atoms_aniso_label: ["Si", "Mg", "O1", "O2", "O3", "O4"]
atoms_aniso_u11: YLgAAHDGAABg0QAAoFQBAJDiAAAg5AAA
atoms_aniso_u22: YLgAAFDDAABg0QAAMPIAAIDtAAAg5AAA
atoms_aniso_u33: EO8AABA6AQBg0QAAcBEBACD9AABw+AAA
atoms_aniso_u12: MFwAAKhhAACwaAAAGHkAAMB2AAAQcgAA
atoms_aniso_u13: AAAAADD4//8AAAAAQAYAAFD7//8AAAAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
pub_title:
 Crystal structure of lizardite-1T from Elba, Italy
 Sample: MFN3-1
 Note: U(1,2) for Mg and O2 have been changed to match symmetry constraints.

qdat:
AAAAAAAAAAAAAAIAAAAAAACAAABABAAAAAAACAAIABAQAIACDAAAACAAACIAgCiAAAEAgCAAgJgEAAEBCBgyAQGAAaBBECAwAGBQlAAogwEFwgiAEIMRBtDghOIFAKMTAHgaAVIahIxUgqFAnFWBROAlAogyRRRtAWBk1S==


formula: Si2 Mg3 O9 H4
compound: <missing>
formula_title: <missing>
a: 5.338
b: 5.338
c: 7.257
alpha: 90
beta: 90
gamma: 120
cell_volume: 179.079
crystal_density: 2.570
atoms_sites: ["Si", "Mg", "O1", "O2", "O3", "O4", "H1", "H2"]
atoms_x: VVgUAOBMFABVWBQAcPMeAGCpKAAAAAAAgEgoAAAAAAA=
atoms_y: q7AoAAAAAACrsCgAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_z: MEQEAJCLGwCA0hEAUGX//1DSIwDgPxIAwFUrAAA1DAA=
atoms_occupancy: 0
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAQA0DAEANAwA=
atoms_aniso_label: ["Si", "Mg", "O1", "O2", "O3", "O4"]
atoms_aniso_u11: 0J0AALCaAABAtQAAcHUBAADIAABAzgAA
atoms_aniso_u22: 0J0AAACWAABAtQAA8AQBAIC7AABAzgAA
atoms_aniso_u33: 8G4AAOCrAADARAAAUJEAABByAAAQWQAA
atoms_aniso_u12: 6E4AAABLAACgWgAAeIIAAMBdAAAgZwAA
atoms_aniso_u13: AAAAAAAAAAAAAAAAEA4AACADAAAAAAAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
pub_title:
 Crystal structure of lizardite-1T from Elba, Italy
 Sample: MFN3-6
 Note: U(1,2) for Si, O2 and O4 have been changed to match symmetry constraints.

qdat:
AAAAAAAAAAAAAAEAAAAAAACAAABABAAAAAAACAAQABAIAIAEDAAAACAAACEAgCiAAAEAgFAAQJgCAAEBCCQyAQCAAWCCEBAwAKBRogBFBIEHIgSAEIYFBGChCSoIgIU0gJgZAowSiFmlBIWgJISDEcALipCyRELeASBYpR==


formula: Hg5 Cl2 O4
compound: <missing>
pub_title: The crystal structure of pinchite, Hg5Cl2O4
formula_title: <missing>
a: 11.619
b: 6.105
c: 11.710
alpha: 90
beta: 90
gamma: 90
cell_volume: 830.637
crystal_density: 9.099
atoms_sites: ["Hg1", "Hg2", "Hg3", "Cl", "O"]
atoms_x: UJMIACDgCQAAAAAAoJoGAADKCAA=
atoms_y: kBcNAICEHgAAAAAA4MgQAGAlDAA=
atoms_z: AAAAAEBCDwBAQg8AgIQeAKC0CgA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Hg1", "Hg2", "Hg3", "Cl", "O"]
atoms_aniso_u11: oAkBAOBaAQDQtgAAgIkAAMDUAQA=
atoms_aniso_u22: MAsBAACvAACgIgEAsK0BALD+AAA=
atoms_aniso_u33: AK8AABDvAAAwUAIAAKkBACCyAAA=
atoms_aniso_u12: kAEAAAAAAAAAAAAAMCoAAOCY//8=
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAADDG//8=
atoms_aniso_u23: AAAAAPDY//8AAAAAAAAAAGAJAAA=
qdat:
AAAAAAAAAAAAAAAAABgIAAAAAIMAAAAAgAIBiADAygCAGAAAwFBcTCgQCsQAhIHOjIUJeBHk4ZfQacNdUNFsVIL823YX0OI13+d0BXt+XF3Ts1vg/4T8oGp7v2i+aqDo6OK9w/4CvV4sYpsgKzrs0wo7kJPjrGDaBLGPzf==


formula: (Mg.751 Fe.249) Si O3
compound: <missing>
formula_title: <missing>
a: 18.2747
b: 8.8729
c: 5.1988
alpha: 90
beta: 90
gamma: 90
cell_volume: 842.983
crystal_density: 3.412
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_x: UO4WAFDuFgAADBcAAAwXAFCVEACQ6RwAwDQLAKBWIgCA/hIA4HMaALB5EgDAURsA
atoms_y: cO8nAHDvJwAAlx0AAJcdAADNFABgixQA8KUUADCsFAAAkR4AEIwdADDWDQAAHAwA
atoms_z: 4Bw1AOAcNQCANxYAgDcWABAuAwDwkzAAkHICAACiMAAABwMAcEcqABCb9f/ggiQA
atoms_occupancy: 4Fs3ACCtBQDgUCQAILgYAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_aniso_u11: yGkAAMhpAAAwhAAAMIQAAGBPAABgTwAAYE8AAGBPAAAwhAAAMIQAADCEAAAwhAAA
atoms_aniso_u22: MFcAADBXAABwdgAAcHYAADBXAADwUAAAMHAAADBwAABwdgAA8GkAAMi0AABwdgAA
atoms_aniso_u33: qFcAAKhXAAAQbQAAEG0AAKBVAACoVwAAeIIAAEB+AAB4kQAASI8AAEBvAAAQXgAA
atoms_aniso_u12: AAAAAAAAAAAw8///MPP//wAAAAAAAAAAMPP//wAAAABg5v//oBkAAAAAAAAw8///
atoms_aniso_u13: gPj//4D4///Y4f//2OH//wAAAACA+P//gBYAAAAAAACA6f//APH//wAAAAAA8f//
atoms_aniso_u23: AAAAAAAAAACYAwAAmAMAAAAAAAAAAAAAaPz//5gDAACIDgAAAAAAANjX//8Q9f//
pub_title:
 A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich
 orthopyroxene, (Mg0.75Fe0.25)2Si2O6
 T = 296 K

qdat:
AAAAAAAAAAAEAAAAEAAAAABCgBwAAgAkDgIEIwEAKXYFQJO5kNDOmo5IbZtARt6arXU5LC9yZHeiL8msr/5b/Xfmaflya9uzea12uOnt16vf6/8ree9f/e3jf3/+ff37zdt5bv/vu2908zt7pnd4XebNmts2zV3Oo/1/u5==


formula: (Mg.751 Fe.249) Si O3
compound: <missing>
formula_title: <missing>
a: 18.3878
b: 8.9577
c: 5.2441
alpha: 90
beta: 90
gamma: 90
cell_volume: 863.768
crystal_density: 3.329
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_x: 8OQWAPDkFgAQARcAEAEXAHCYEAAw+RwAQEELADBYIgCA/hIAIHoaAHBzEgCwXBsA
atoms_y: EM0nABDNJwBgoB0AYKAdAIDAFAAwkxQAUK8UADDFFAAQbR4AUJIdAEAWDgCgjwwA
atoms_z: sLo1ALC6NQCg6RYAoOkWAACdAwBwIzAAYBADAKA0MAAAzwMAQLMqAICy9f/wliMA
atoms_occupancy: gOg3AIAgBQBAxCMAwEQZAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_aniso_u11: GEEBABhBAQC44QEAuOEBABDWAAAQ1gAAENYAABDWAABokQEAAMcBAGAmAQCwdgEA
atoms_aniso_u22: mCoBAJgqAQA4owEAOKMBAADrAABo8QAAgIMBAICDAQCoPQEAmCoBACD8AQDgrwEA
atoms_aniso_u33: kPEAAJDxAACoYAEAqGABABjTAADo0AAAiCEBAMBIAQBgdgEAEDUBAAAOAQAAQAEA
atoms_aniso_u12: AAAAAAAAAADQy///0Mv//+jl//8YGgAA8Nj///DY///ApP//cI8AABgaAADQy///
atoms_aniso_u13: 4Nn//+DZ//9Qfv//UH7//wAAAAAI6f//UA8AAJDK///g2f//kMr//wjp///ILQAA
atoms_aniso_u23: AAAAAAAAAABYFgAAWBYAACjx//+ABwAA2A4AABgaAADYDgAAsB0AAABv//9Ydv//
pub_title:
 A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich
 orthopyroxene, (Mg0.75Fe0.25)2Si2O6
 T = 1000 K

qdat:
AAAAAAAAAAAIAAAAIAAAAABJADgABACIHAQQTAIApNgVAk7mQoNS1HIjWnYFNvnZe7lL4n82R/Yi9JtLu2W/1rrer59Tu3RrNaffHXv02v/++07+fffX+vi7//+2b//m+/6/f/retzr7L/39c3xd38+cmravfczl+v7vu1==


formula: (Mg.751 Fe.249) Si O3
compound: <missing>
formula_title: <missing>
a: 18.4105
b: 8.9691
c: 5.2540
alpha: 90
beta: 90
gamma: 90
cell_volume: 867.570
crystal_density: 3.315
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_x: 8OQWAPDkFgDw/RYA8P0WAACaEADg/RwAYEQLADBYIgDw/BIAYIAaAHBzEgAQZhsA
atoms_y: YMgnAGDIJwCAox0AgKMdANC7FAAAmxQAILcUAFDIFAAAXx4A0J4dAAApDgBAuAwA
atoms_z: oN41AKDeNQCAGBcAgBgXACC5AwCA/y8AIDwDAAAlMADg/QMAQMwqANDG9f9ARyMA
atoms_occupancy: IP42AOAKBgCgriQAYFoYAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_aniso_u11: oHcBAKB3AQBwMwIAcDMCAGjxAABo8QAASAwBAGjxAADY/QEAGMgBAICSAQCAkgEA
atoms_aniso_u22: 6FcBAOhXAQBA1wEAQNcBAIALAQDAEQEACH4BADDEAQBgcQEACDgBAJhWAgDIAwIA
atoms_aniso_u33: MCkBADApAQCojQEAqI0BAHDaAACA8gAASGYBANhsAQCIowEASKwBAGArAQDohAEA
atoms_aniso_u12: AAAAAAAAAADI2P//yNj//8jY//8AAAAAAAAAAOjl//8gY///wI8AAOjl///I2P//
atoms_aniso_u13: wML//8DC//+Ahf//gIX//wAAAABg4f//qAcAABDS//8Q0v//WPj//wAAAABIJgAA
atoms_aniso_u23: gAcAAIAHAAAYGgAAGBoAAAAAAAAAAAAAqOn//9gdAACYIQAA8DcAALBQ//+wUP//
pub_title:
 A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich
 orthopyroxene, (Mg0.75Fe0.25)2Si2O6
 T = 1100 K

qdat:
AAAAAAAAAAAIAAAAIAAAAABJAGgACACQGAQQjAQBKdgqAl+qhoJ0lOJCbHwGV+ma31pLQn1qT/pl+L2V/8d/rPSdPzxndWjXWz2uO/fl9f91tp38/+++6/E3//59//vN9/r+/7dty7fkftvy6tD/VRJ7evm2drmX537u7T==


formula: (Mg.751 Fe.249) Si O3
compound: <missing>
formula_title: <missing>
a: 18.4317
b: 8.9822
c: 5.2647
alpha: 90
beta: 90
gamma: 90
cell_volume: 871.609
crystal_density: 3.299
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_x: YOMWAGDjFgCw9xYAsPcWAJCbEABABx0AoEoLAHBeIgAwAxMAMIgaAOBxEgCgZxsA
atoms_y: cL0nAHC9JwBwrh0AcK4dAEC6FABAoRQAALQUAADmFADQTR4AYLkdALBGDgCACQ0A
atoms_z: QDk2AEA5NgBQhBcAUIQXAAABBABwpi8AIKADANDILwBgbgQAwAorAGDh9f8AkiIA
atoms_occupancy: IAQ2AOAEBwCgqCUAYGAXAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_aniso_u11: UK4BAFCuAQB4hQIAeIUCAOgMAQDoDAEACPIAAKhCAQCwNAIA0BkCADDJAQCIXQEA
atoms_aniso_u22: kKUBAJClAQAIMgIACDICAPg4AQD4OAEAIPIBAAi/AQAonwEAoLgBADDrAgAw6wIA
atoms_aniso_u33: oE8BAKBPAQAI5wEACOcBALgAAQBwKgEA2GcBAFCaAQBI3gEAaOsBAGA1AQBAIgIA
atoms_aniso_u12: AAAAAAAAAACIvv//iL7//8Dl//8gDQAAAAAAAIi+//9wO///cLcAAFg0AABosf//
atoms_aniso_u13: 6NH//+jR///AXv//wF7//wAAAAA44f//+BYAADjh//8gs///COn//zjh///IHgAA
atoms_aniso_u23: gAcAAIAHAAAAHgAAAB4AAADx//8AAAAAAAAAAMD0//+AJQAA2EoAADgj//845/7/
pub_title:
 A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich
 orthopyroxene, (Mg0.75Fe0.25)2Si2O6
 T = 1200 K

qdat:
AAAAAAAAAAAIAAAAIAAAAACKAGgACACQOAggjAQBSbAqBF3MhYapqORGVPwKb9Ozv7aVxL5Uj/TL8jsVv4373em6enSu/vm81ptc9d/Pa///6zv5/9993ePv13zb/9e//3a9Xv3bvcrJfe+ru8LvNi1k+bW9TmY/v/d5k/==


formula: (Mg.751 Fe.249) Si O3
compound: <missing>
formula_title: <missing>
a: 18.5132
b: 8.9809
c: 5.3243
alpha: 90
beta: 90
gamma: 90
cell_volume: 885.246
crystal_density: 3.249
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_x: IN0WACDdFgAQ6BYAEOgWAFCVEADQIR0AEEkLAKBvIgBgFBMAMKEaAKBrEgDAgxsA
atoms_y: YK8nAGCvJwBguR0AYLkdAHCyFABwshQAINAUAPDwFADwNx4AoCMeAMCGDgDQrQ4A
atoms_z: wHE3AMBxNwAA5xgAAOcYAFAPBQDAdS4AQM8EANCcLgBgmgUA8BUsAMCA9v9grR8A
atoms_occupancy: oMU1AGBDBwAg5yUA4CEXAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "SiA", "SiB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B"]
atoms_aniso_u11: SOgBAEjoAQCA3AIAgNwCAKhgAQBwKgEAcCoBAKhgAQCw9wIAGIsCAAiXAQDgVAIA
atoms_aniso_u22: 4L4BAOC+AQCokQIAqJECAHBSAQCIhQEA4DECAJgLAgAAnwEAkOsBAOh9AwCAowQA
atoms_aniso_u33: aH0BAGh9AQDgEwIA4BMCAIAzAQCwNQEAGJYBALBSAgBIMwIAgCMCAEDXAQAYswIA
atoms_aniso_u12: AAAAAAAAAABYy///WMv//3jY//9AGgAAAAAAAFjL///oVP//APoAAMDl//9wfP//
atoms_aniso_u13: 8Nj///DY//9Ye///WHv//5Do//9g8P//2Ln//5Do///QBwAA4C4AAAAAAACwNgAA
atoms_aniso_u23: aAsAAGgLAABoCwAAaAsAAID4///oEgAAkBoAAKA8AACABwAAqBYAADDR/v+QfP3/
pub_title:
 A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich
 orthopyroxene, (Mg0.75Fe0.25)2Si2O6
 T = 1300 K

qdat:
AAAAAAAAAAAIAAAAQAAAAACMAEgAEAEgUAhBJAgKE6FCIazQnRjhkpCNM6gJs5mPNvEPFt3R7dTd8qnVe53bW6tzbm3u169vnO1at/2vH/TP31f63fvH35/d///++8buvrz7S7Xui+L2z6dXPdbdlavU38/qwt797qXC/r==


formula: Ce P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures
formula_title: <missing>
a: 6.7902
b: 7.0203
c: 6.4674
alpha: 90
beta: 103.38
gamma: 90
cell_volume: 299.928
crystal_density: 5.206
atoms_sites: ["Ce", "P", "O1", "O2", "O3", "O4"]
atoms_x: wC4RAICaEgDQQw8AYEcXAGDxHACgxgcA
atoms_y: 6LgJAODyCQBAagAAMC8UAOCHBgAQJA0A
atoms_z: cBsGABBcJQAgKRsAcF0eANANMQAAXCsA
atoms_occupancy: 0
atoms_u_iso: KEEAAGg9AACwfAAAkIgAAIiQAACwfAAA
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:
AAAAAAAAAAAAAAABAAAAABIAAAAAAFACAJQgEAAIgBCECAAFARgkQQBBwCQqgDgYhZGlYAjNgkAIcD106mUCWEgkONtuh0U1Jnozxps02WtVpXqvtRTHa1dudo01bvtSd962GW86nLs7Vfv3Pu/d3X++vp/7/7+7f795f/==


formula: La P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures La(PO4)
formula_title: <missing>
a: 6.8313
b: 7.0705
c: 6.5034
alpha: 90
beta: 103.27
gamma: 90
cell_volume: 305.732
crystal_density: 5.081
atoms_sites: ["La", "P", "O1", "O2", "O3", "O4"]
atoms_x: EC8RAPCYEgDwRg8A8C8XAMD6HABQywcA
atoms_y: KMkJAPAACgBQeAAAsDsUAHCJBgCAOw0A
atoms_z: ICUGABBcJQBQUxsAQEweACDwMABQVysA
atoms_occupancy: 0
atoms_u_iso: IDoAAFBBAABgmgAAyHgAALB8AACgggAA
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:
AAAAAAAAAAAAAAACAAAAACQAAAAAAKAEAUhAIAAhAEEQIAAcBGCRBAENAJCyAcBiHIaZACZ8EgBDAqpnU1AixIFDh7d4dNNSZ6c8apJvltWs7tTtoYzvau3u0ea1735ftezCPedHH/71/r/3ds/7166/y///V3/fe3RbtW==


formula: Ce P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Ce(PO4)
formula_title: <missing>
a: 6.7880
b: 7.0163
c: 6.4650
alpha: 90
beta: 103.43
gamma: 90
cell_volume: 299.486
crystal_density: 5.214
atoms_sites: ["Ce", "P", "O1", "O2", "O3", "O4"]
atoms_x: cDMRAPCYEgDATg8AsEIXABD2HABAvQcA
atoms_y: kLYJALD6CQDwVQAAgEMUAOBuBgBANQ0A
atoms_z: wBsGAMBgJQCgNRsAYGgeAKAVMQBAYisA
atoms_occupancy: 0
atoms_u_iso: UFUAAPBkAAAQuAAASJ4AAECmAABYmAAA
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:
AAAAAAAAAAAAAAABAAAAABIAAAAAAFACAJQgEAAIgBBECAAHARgkQQBBwBQWQDgMQ5DlIATPgkAIMD1qeWUCXEgSOFWrhUs1Jm4qplkyfXdNo3anrQxnNtfbd06d7rnKd1ezCSUdjn89Vv+/v16tdz3df5e//+v9vt34v/==


formula: Pr P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Pr(PO4)
formula_title: <missing>
a: 6.7596
b: 6.9812
c: 6.4344
alpha: 90
beta: 103.53
gamma: 90
cell_volume: 295.213
crystal_density: 5.307
atoms_sites: ["Pr", "P", "O1", "O2", "O3", "O4"]
atoms_x: qDIRAACOEgAgPw8AgEoXAID0HADAsAcA
atoms_y: cK4JAODyCQCwTwAAcE4UAGBiBgBgHw0A
atoms_z: oBgGAHBlJQAQGxsA4HQeABAtMQAAdSsA
atoms_occupancy: 0
atoms_u_iso: iEUAAEBHAACQiAAAqIQAALB8AACoegAA
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:
AAAAAAAAAAAAAAAAgAAAABEAAAAAACgBAEoQCAAEIAQhAgABgEQJIEAQUAUFoAoCEOQ0qAESoJABDAuujkzASwkERx99cKllqG3GVFqjR661mn6sduFMZtVu53jT3u+cp/07MFZxyeP73L9f/e/dq7vV6/6v39zf77Rv6f==


formula: Nd P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Nd(PO4)
formula_title: <missing>
a: 6.7352
b: 6.9500
c: 6.4049
alpha: 90
beta: 103.68
gamma: 90
cell_volume: 291.306
crystal_density: 5.454
atoms_sites: ["Nd", "P", "O1", "O2", "O3", "O4"]
atoms_x: 0DIRAFCJEgBgRQ8A8EgXADD5HACQnwcA
atoms_y: sKUJAKDsCQDgRwAAsFQUAABZBgAQJA0A
atoms_z: sBIGAHBlJQDgCRsAMHAeABBGMQDwfysA
atoms_occupancy: 0
atoms_u_iso: eDcAAGA7AACohAAAyHgAAKh6AAD4ZgAA
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:
AAAAAAAAAAAAAAAAgAAAAAiAAAAAABQAgCUIBAACEAIIgQAAwCMCiBAIOAFBqAMAhFkNSgBErBIAQwLrk1EYEWFBEKOvrh0tuQ3Yy0pMbO3um12tj6oVhn2m/n+dOa1x1DvXOhT/PZ4/Xelz3s/3PXrO7d8nzP7b/rdm31==


formula: Sm P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Sm(PO4)
formula_title: <missing>
a: 6.6818
b: 6.8877
c: 6.3653
alpha: 90
beta: 103.86
gamma: 90
cell_volume: 284.416
crystal_density: 5.729
atoms_sites: ["Sm", "P", "O1", "O2", "O3", "O4"]
atoms_x: 6C4RAKCEEgCwQA8A4FMXAMD6HACQbQcA
atoms_y: cIsJACDgCQBAHwAAUGQUAJBBBgBQ+AwA
atoms_z: SP0FACBqJQDQ4hoAAJEeAGBzMQAQaisA
atoms_occupancy: 0
atoms_u_iso: KC0AAIgxAADQcAAA0HAAAMhuAADQcAAA
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:
AAAAAAAAAAAAAAAAQAAAAARAAAAAAAYAIBFCAQAAhACCIEAAOASgUgIBBwBQLIBwEEcRZOAMToJABDA3qTyZgJoSCI00/XDwzahmpnpqc6WmOm1/1j7okx23S3nVMne64xh/ruYs/z0+fxnj8/+ed7P6z/dXt+t/73d/81==


formula: Eu P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Eu(PO4)
formula_title: <missing>
a: 6.6613
b: 6.8618
c: 6.3491
alpha: 90
beta: 103.96
gamma: 90
cell_volume: 281.636
crystal_density: 5.824
atoms_sites: ["Eu", "P", "O1", "O2", "O3", "O4"]
atoms_x: wC4RANB8EgCQVg8AEGUXAPDyHABAWQcA
atoms_y: uIQJAHDbCQDAEgAAYHIUAOA8BgDwBw0A
atoms_z: iPQFACBqJQAQ6RoAEJ8eAECJMQBwcysA
atoms_occupancy: 0
atoms_u_iso: ICYAAIAvAACIhgAA+GYAANhoAAAAXwAA
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:
AAAAAAAAAAAAAAAAQAAAAARAAAAAAAMAIAkhAIAAQgBBECAAHAIwKQEAQoAUFkAYDCNEkXACM8EQAQwOrktGYCeEgiNNv1waMWoZ6d6bTGn0yl6v6o9VIub+0Wt2xp7fVHcP9exEneerx+M8/3v7z/Z/zP939n///u79/T==


formula: Gd P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Gd(PO4)
formula_title: <missing>
a: 6.6435
b: 6.8414
c: 6.3281
alpha: 90
beta: 103.976
gamma: 90
cell_volume: 279.103
crystal_density: 6.002
atoms_sites: ["Gd", "P", "O1", "O2", "O3", "O4"]
atoms_x: cC4RAPB/EgAwfw8AUGsXABDdHACwPgcA
atoms_y: aHoJAMDWCQBQFAAAIGwUAIAzBgCgDA0A
atoms_z: 2OoFALBrJQCQwxoAAKoeAOCYMQAwhisA
atoms_occupancy: 0
atoms_u_iso: oDwAAChLAABIngAAoIIAAKh6AACohAAA
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:
AAAAAAAAAAAAAAAAQAAAAAJAAAAAAAKAEAShAIAAIQAhCBAACgEoFICAQUAKCyAMAhCiSKwBiVCIAIIF6xeTEAnhIIjT1dcNDNqGamemkxp+MpKr2qPXRLmqqEvfaJO/txyB+1/Ys1nlafi3n83/ed7P6Z+6/k2/+93ev6==


formula: Y P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures
formula_title: <missing>
a: 6.8947
b: 6.8947
c: 6.0276
alpha: 90
beta: 90
gamma: 90
cell_volume: 286.533
crystal_density: 4.262
atoms_sites: ["Y", "P", "O"]
atoms_x: AAAAAAAAAAAAAAAA
atoms_y: wMYtAEBCDwCQmAQA
atoms_z: IKEHAGDjFgDgKw0A
atoms_occupancy: 0
atoms_u_iso: AFoAAKh6AAAYugAA
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:
AAAAAAAAAAAAAAAAAAAAAAAgAAAAAAIAAAAAAAQABAAgAAAABAAAAAIAAEAICAQAAgABAUAAAQADAAgAAGACBAgAQAAQYIgQgwBAAACIAAkSAEMBBAFIAAEIhEMCAIRABHIgApARDRAhiRIYIEOgQGSDGCKiQgGEwKpMJS==


formula: Tb P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Tb(PO4)
formula_title: <missing>
a: 6.9309
b: 6.9309
c: 6.0606
alpha: 90
beta: 90
gamma: 90
cell_volume: 291.135
crystal_density: 5.793
atoms_sites: ["Tb", "P", "O"]
atoms_x: AAAAAAAAAAAAAAAA
atoms_y: wMYtAEBCDwDAqQQA
atoms_z: IKEHAGDjFgBwRg0A
atoms_occupancy: 0
atoms_u_iso: OEUAAChVAADAdgAA
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:
AAAAAAAAAAAAAAAAAAAAAAAgAAAAAAQAAAAAAAgACACAAAAAEAAAAAgAAQAgEBAACAAEBQAABAAUAEAAAwAQEEACAACDBECEGAIAAARAAFEQAhAIIBxAABCIRDAgCCQARyIAKQEQiQIxIUECCHQIFJBjhFhoQFCYKilEqA==


formula: Dy P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Dy(PO4)
formula_title: <missing>
a: 6.9052
b: 6.9052
c: 6.0384
alpha: 90
beta: 90
gamma: 90
cell_volume: 287.922
crystal_density: 5.940
atoms_sites: ["Dy", "P", "O"]
atoms_x: AAAAAAAAAAAAAAAA
atoms_y: wMYtAEBCDwCAowQA
atoms_z: IKEHAGDjFgAgMg0A
atoms_occupancy: 0
atoms_u_iso: cEQAAChVAADIeAAA
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:
AAAAAAAAAAAAAAAAAAAAAAAgAAAAAAIAAAAAAAQABABAAAAACAAAAAQAAIAQCAQABAABAYAAAQAGABAAAMAEBBAAgAAgwRAhBgCAAAEQAAxEAIYBCAMQAAYSEIoEAgiACOSABSAiCSBGJCgwQQaAgVIGcImFBAYRAqSYkp==


formula: Ho P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Ho(PO4)
formula_title: <missing>
a: 6.8773
b: 6.8773
c: 6.0176
alpha: 90
beta: 90
gamma: 90
cell_volume: 284.616
crystal_density: 6.065
atoms_sites: ["Ho", "P", "O"]
atoms_x: AAAAAAAAAAAAAAAA
atoms_y: wMYtAEBCDwDQngQA
atoms_z: IKEHAGDjFgDQNg0A
atoms_occupancy: 0
atoms_u_iso: sAkAAGgzAAAoSwAA
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:
AAAAAAAAAAAAAAAAAAAAAAAQAAAAAAEAAAAAAAQAAgAgAAAABAAAAAIAACAIBAIAAQAAQKAAAIABgAQAADABAQQAIAAIMEIIIYAgAABCAAKIgBCAQQDiAADEQRFAgCEgARyQAGQEQyQQZIUCCCDIEClAxgiokEBhMDJSiS==


formula: Er P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Er(PO4)
formula_title: <missing>
a: 6.8508
b: 6.8508
c: 5.9968
alpha: 90
beta: 90
gamma: 90
cell_volume: 281.451
crystal_density: 6.189
atoms_sites: ["Er", "P", "O"]
atoms_x: AAAAAAAAAAAAAAAA
atoms_y: wMYtAEBCDwDwiAQA
atoms_z: IKEHAGDjFgAALw0A
atoms_occupancy: 0
atoms_u_iso: UFAAAABfAACYgAAA
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:
AAAAAAAAAAAAAAAAAAAAAAAQAAAAAAEAAAAAAAIAAgAQAAAAAgAAAAEAABACAQEAAIAAIDAAACAAwAIAAAwAQIEACAACDCCCCCCIAAAIgACiIAQwCCAYgAAYiEIwEAgkACORABSAiESCBIigQIQJAQMkFOENCQgMFQNKMJ==


formula: Tm P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Tm(PO4)
formula_title: <missing>
a: 6.8294
b: 6.8294
c: 5.9798
alpha: 90
beta: 90
gamma: 90
cell_volume: 278.902
crystal_density: 6.285
atoms_sites: ["Tm", "P", "O"]
atoms_x: AAAAAAAAAAAAAAAA
atoms_y: wMYtAEBCDwAAZQQA
atoms_z: IKEHAGDjFgAgAA0A
atoms_occupancy: 0
atoms_u_iso: oBQAAKgbAABgOwAA
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:
AAAAAAAAAAAAAAAAAAAAAAAIAAAAAACAAAAAAAEAAQAIAAAAAQAAAACAAAgBAICAACAAEBgAABAAUACAAAYAECCABAAAgwggghhCAAAEIAAoiAEMAggGIAAGIgiMBAEIgAhkQAMgERkgQYkYECCDICBkgpgiokIBgqBIyR==


formula: Yb P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Yb(PO4)
formula_title: <missing>
a: 6.8093
b: 6.8093
c: 5.9639
alpha: 90
beta: 90
gamma: 90
cell_volume: 276.526
crystal_density: 6.438
atoms_sites: ["Yb", "P", "O"]
atoms_x: AAAAAAAAAAAAAAAA
atoms_y: wMYtAEBCDwBAhAQA
atoms_z: IKEHAGDjFgBgHw0A
atoms_occupancy: 0
atoms_u_iso: eDcAAOhiAADoYgAA
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:
AAAAAAAAAAAAAAAAAAAAAAAIAAAAAABAAAAAAACAAIAEAAAAAIAAAABAAAQAgEAgABAACAwAAAQAGABAAAGACAggAQAAIYIQIIYAgAABCAAEIgBDAIIBiAABiEIhAQBCIAEZEABIBEIkEGJCAgQgxAgMkJMCZEiAIGQIkS==


formula: Lu P O4
compound: <missing>
pub_title: Crystal chemistry of the monazite and xenotime structures Lu(PO4)
formula_title: <missing>
a: 6.7828
b: 6.7828
c: 5.9467
alpha: 90
beta: 90
gamma: 90
cell_volume: 273.586
crystal_density: 6.554
atoms_sites: ["Lu", "P", "O"]
atoms_x: AAAAAAAAAAAAAAAA
atoms_y: wMYtAEBCDwBwfAQA
atoms_z: IKEHAGDjFgCgDA0A
atoms_occupancy: 0
atoms_u_iso: cDAAAGg9AAD4ZgAA
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:
AAAAAAAAAAAAAAAAAAAAAAAEAAAAAABAAAAAAABAAEACAAAAAEAAAAAgAAIAQBAQAAgAAgUAAAIABAAQAADAAgIIAIAACGCECCGAIAAAQgADCEAIQCCAIQAAIRCEYCAIiAAjIgAYgITERAxEYECECICBkREgREiQAgRAkR==


formula: O24 Si8 Mn4.72 Mg.28 Na2.798 Ca.03 K.152
compound: Hoskins mine, Grenfell, New South Wales, Australia
formula_title: <missing>
a: 9.889
b: 18.033
c: 5.296
alpha: 90
beta: 105.08
gamma: 90
cell_volume: 911.904
crystal_density: 3.446
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:
 A new anhydrous amphibole from the Hoskins mine, Grenfell, New South Wales,
 Australia: Description and crystal structure of ungarettiite, NaNa2(Mn2Mn3)Si8O22O2
 Sample U1

atoms_sites:
["O1", "O2", "O3", "O4", "O5", "O6", "O7", "Si1", "Si2", "Mn1", "Mn2", "Mg2", "Mn3", "Mg3", "Na4", "Ca4", "NaAm", "KAm", "NaA2", "KA2"]

atoms_x:
kFQHACAkBwCQkgUAAEoVAABjFQDgRhUA4F8VANCbEQBghBEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAKA1AgCgNQIAAAAAAAAAAAA=

atoms_y:
ABQFAKC6CQAAAAAAQCkPAHC1BwCQOwcAAAAAAIAgBQAAQQoA4PcEAKAxCwCgMQsAAAAAAAAAAACgqRAAoKkQAICEHgCAhB4AEL4dABC+HQA=

atoms_z:
MKoMAHBBKwAg3CsAAD4wAMBeBACAGyMAYOgRAHB5EQDQ+i8AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAODFBADgxQQAAAAAAAAAAAA=

atoms_occupancy:
AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AEBSNgDAtgYAgF85AICpAwCgHjwAYOoAAGCiDADAUQIAYKIMAMBRAgA=

atoms_u_iso:
kIgAALh+AAC4fgAAAL4AACiqAABApgAAELgAAPBkAADoYgAA+FwAAMh4AADIeAAAIFMAACBTAACoOAEAqDgBACAkAgAgJAIAUBICAFASAgA=

qdat:
AAAAAAAAAAACIAAAAAAAGAgUBAIAAAAggKBCAQCAEwUFAMEgsCBYsnIQwNwQCPkHAHBeYzOcBBWJBsHAEDSEeSz1E4RYHy6RTFBIZuNzQxzYcT6WUNAVOvwlhHrWUieeZcpYNALZuII+BYGZRwmeqNGyslXexGwBMpwHaE==


formula: O24 Si8 Mn4.71 Mg.29 Na2.77 Ca.03 K.152
compound: Hoskins mine, Grenfell, New South Wales, Australia
formula_title: <missing>
a: 9.893
b: 18.041
c: 5.295
alpha: 90
beta: 105.10
gamma: 90
cell_volume: 912.419
crystal_density: 3.441
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:
 A new anhydrous amphibole from the Hoskins mine, Grenfell, New South Wales,
 Australia: Description and crystal structure of ungarettiite, NaNa2(Mn2Mn3)Si8O22O2
 Sample U2

atoms_sites:
["O1", "O2", "O3", "O4", "O5", "O6", "O7", "Si1", "Si2", "Mn1", "Mn2", "Mg2", "Mn3", "Mg3", "Na4", "Ca4", "Na2", "KAm", "NaA2", "KA2"]

atoms_x:
AFMHALAlBwAglAUAIE0VAABjFQAAShUA4F8VANCbEQBghBEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAMA4AgDAOAIAAAAAAAAAAAA=

atoms_y:
ABQFAIC3CQAAAAAA0CoPAOCzBwAgPQcAAAAAABAiBQAAQQoAcPkEAKAxCwCgMQsAAAAAAAAAAAAQqBAAEKgQAICEHgCAhB4AAOIdAADiHQA=

atoms_z:
0LkMAPA0KwAg3CsAIEEwAIBYBAAwICMAUPMRAOB3EQDw/S8AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAKDYBACg2AQAAAAAAAAAAAA=

atoms_occupancy:
AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AEBSNgDAtgYAQMM4AMBFBACgHjwAYOoAAAA1DADAUQIAADUMAMBRAgA=

atoms_u_iso:
sHwAALB8AACAjgAAGLoAAEioAAA4pAAAELgAAPhcAADoYgAA+FwAANhyAADYcgAAOE8AADhPAADwIgEA8CIBALBNAgCwTQIAkFkCAJBZAgA=

qdat:
AAAAAAAAAAACIAAAAAAAEAgUBAIAAAAggKBCAQCAIwUFAMEQsCCIsrIQoNwQCPkFAHBeYzG8CBaLBoHAEDyEOSz3E4RYHz6RTFBYZuNzQxzYcT5WmLAlOfwnhHrWkieeZcpYPALIuII9BIGZRomeqNDyalXexGwBOlwH6E==


formula: K.948 Zn2.406 Al2 Ca14 Si20 O64 H8
compound: <missing>
pub_title: Crystal structure of minehillite: Twinning and structural relationships to reyerite
formula_title: <missing>
a: 9.777
b: 9.777
c: 33.293
alpha: 90
beta: 90
gamma: 120
cell_volume: 2756.099
crystal_density: 2.896
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
atoms_sites:
["K", "Zn", "Al", "Ca1", "Ca2", "Ca3", "Si1", "Si2", "Si3", "Si4", "O-h1", "O2", "O-h3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "H1", "H2"]

atoms_x:
AAAAAAAAAABVWBQAVVgUAGCQNwDILC4Aq7AoAFBFLgDwQzUAYIc2AAAAAACrsCgAgBoGAOA5LABw1SMAkI0KAND/EQBwVx8A8AoZAIDeDwAwux4A4DIQAAAAAADgBAcA

atoms_y:
AAAAAJgrHgCrsCgAq7AoAJCtFwCI1fz/VVgUAOCaBwAgkA4AALIMAAAAAABVWBQAUBclAMDZ/P9goe//wCAfANByAwBgOhUAoMIQALB4DgAQlAsAANUCAAAAAABAOyUA

atoms_z:
QEIPAEBCDwDAUw8AwOMGACjRBgDQ3gUA+OwBAMBwCwDoCRMAiFMBAFCABwAQ1wQA0MEEAGgiDADooAgAQFMNAIAZDABwNw0AyJMIAEjaAACQ0wAAQBEEACCbCADgmQMA

atoms_occupancy:
gNw5AEDzMAAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
8GgBACCZAAAAfQAAIJkAAECcAACQsAAAoHMAAMB2AADwbgAAcHsAAGDqAAAwpwAAEL0AAJDJAACgvgAAgKIAADDyAACgpQAAYLgAAGDRAADw0gAAgNQAAIA4AQCAOAEA

qdat:
AAAAAAIAAAAAMBAAACBAAGMIDUEBkACUDpgsITgUgKBpDuJIWHA4BxuMT0zGBB4YPlSpR8yMKIUPNdJMKeaIhDz1ma05SNSQjre7ie0lIT1d/t7u5O9GhC6urJ3bI3Uqndv3bL6UiJqu37X9pF6lEQ/+2dlykiAABr1L6U==


formula: Pb Al F3 O2 H2
compound: <missing>
formula_title: <missing>
a: 6.270
b: 6.821
c: 5.057
alpha: 90.68
beta: 107.69
gamma: 104.46
cell_volume: 198.618
crystal_density: 5.438
atoms_sites: ["Pb", "Al", "F1", "F2", "F3", "O-h1", "O-h2", "H1", "H2"]
atoms_x: 2OcSAOB/MQDghTAAcDUtAJBaHwDQqjQA0NA2AGBBMQDAnDQA
atoms_y: 8K4LABD6EwAgaQgAMNodAEAWDgCgpyEAgL0IACARHwBAcgcA
atoms_z: AGwMAMAMMwDwGSMAMFgiAJCEMQDQ/AUAwAcGACBxDwBgkA8A
atoms_occupancy: 0
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AIA4AQCAOAEA
atoms_aniso_label: ["Pb", "Al", "F1", "F2", "F3", "O-h1", "O-h2"]
atoms_aniso_u11: UIcAANCEAACgCQEAgLsAAKCMAAAAfQAAQJwAAA==
atoms_aniso_u22: 2F4AAHBJAADQawAAkH4AABCkAAAQcgAAwHYAAA==
atoms_aniso_u33: wNoAAECcAABg6gAA4KsAAGBnAQAgywAAYG0AAA==
atoms_aniso_u12: uCQAAAAZAADgLgAAMEMAAJABAAAwKgAA4C4AAA==
atoms_aniso_u13: +DQAAHAwAACgjAAAQB8AAMBdAAAgTgAA4C4AAA==
atoms_aniso_u23: YBgAAMASAACwBAAAwCsAAEAfAACgDwAA0CAAAA==
pub_title:
 Artroeite, PbAlF3(OH)2, a new mineral from the Grand Reef mine, Graham County,
 Arizona: Description and crystal structure

qdat:
AAAAAAAAAAAAAAAAgAQAABAAAAAQQAABEAAAIAAQKAAGAAABgAQAIAcEEIAABAALBVAKBITACIAGCMMSiMIAeQJJHRQgSIKHkiQAohcE2IAJLwAlToNC23AIBeq2UMVNFhwvkkOJCB8ydcmeiNC9mTM/jbD2zgO3F076uf==


formula: (Mg1.76 Fe.24) Si O4
compound: <missing>
formula_title: <missing>
a: 4.740
b: 10.230
c: 5.960
alpha: 90
beta: 90
gamma: 90
cell_volume: 289.002
crystal_density: 3.408
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAAAQaDwAEGg8ALAXGgAgyi4AcHgNAEAEEQA=
atoms_y: AAAAAAAAAABABBEAQAQRABC4BQBQjAUA8GIbAND9CQA=
atoms_z: AAAAAAAAAABAQg8AQEIPAEBCDwBAQg8AQEIPAJAOAgA=
atoms_occupancy: YKY1AKBiBwCgxTUAYEMHAAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_aniso_u11: 0FIAANBSAAAQcgAAEHIAAPA8AAAgTgAA0GsAAEBqAAA=
atoms_aniso_u22: kEwAAJBMAACQTAAAkEwAAJAaAACAcAAAIBwAAKBaAAA=
atoms_aniso_u33: oFoAAKBaAADAXQAAwF0AAPA8AADAXQAA8G4AAOBgAAA=
atoms_aniso_u12: QO3//0Dt//9gCQAAYAkAADARAADwCgAAIAMAACADAAA=
atoms_aniso_u13: wPn//8D5//8AAAAAAAAAAAAAAAAAAAAAAAAAACADAAA=
atoms_aniso_u23: MPj//zD4//8AAAAAAAAAAAAAAAAAAAAAAAAAAKAPAAA=
pub_title:
 High-temperature Fe-Mg cation partitioning in olivine: In-situ single-crystal
 neutron diffraction study
 T = room temperature
 Atomic parameters obtained from the ICSD

qdat:
AAAAAAAAAAAAAAAAAAAAMAAAAAAAQAgAAABYAAAACmCAQIIECCADADwAGYsAqkBAJBAGGPJGAXY6WiABgpBq6OiQMyXT9tiTK8J9kqZujoVu4u3lpbN06vp50O58287Kv5C9P2Xoq1T3fVu26276nY+XL72/hguv6+6bXe==


formula: (Mg1.76 Fe.24) Si O4
compound: <missing>
formula_title: <missing>
a: 4.76
b: 10.33
c: 6.05
alpha: 90
beta: 90
gamma: 90
cell_volume: 297.483
crystal_density: 3.310
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAAAgjzwAII88AKAJGgDw0S4AMHINAFArEQA=
atoms_y: AAAAAAAAAADg+hAA4PoQAADDBQCQkgUAgH0bAODyCQA=
atoms_z: AAAAAAAAAABAQg8AQEIPAEBCDwBAQg8AQEIPAEAsAgA=
atoms_occupancy: gPo0AIAOCACAcTYAgJcGAAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_aniso_u11: cNkBAHDZAQAwiAEAMIgBAKBaAAAw2QAA0LYAADA9AQA=
atoms_aniso_u22: 0GUBANBlAQBQ3AAAUNwAAJB+AAAQOgEAoIwAAKAJAQA=
atoms_aniso_u33: 0DMBANAzAQDAiQEAwIkBACAvAQBAMgEAQMgBAEAyAQA=
atoms_aniso_u12: YCIAAGAiAABQLQAAUC0AANA5AADwbgAAgNr//1Di//8=
atoms_aniso_u13: 4LH//+Cx//8AAAAAAAAAAAAAAAAAAAAAAAAAAFDJ//8=
atoms_aniso_u23: ENz//xDc//8AAAAAAAAAAAAAAAAAAAAAAAAAABCLAAA=
pub_title:
 High-temperature Fe-Mg cation partitioning in olivine: In-situ single-crystal
 neutron diffraction study
 T = 880 C
 Atomic parameters obtained from the ICSD

qdat:
AAAAAAAAAAAAAAAAAAAAoAAAAAAAgBAAAAGgAAAAUoIAgRAIMIAkBMAA5LAFxAICgQAwx8gwSoG1IwBYUQi0lpIUyLbO5QKWXj9YoNTjQxy4tM+Nl7sNzjVr7C7vqplaxMsP8+Sa3z+97r8Xo+6+nbb+rdO5bf/dZr1775==


formula: (Mg1.76 Fe.24) Si O4
compound: <missing>
formula_title: <missing>
a: 4.769
b: 10.33
c: 6.037
alpha: 90
beta: 90
gamma: 90
cell_volume: 297.405
crystal_density: 3.311
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAACwkDwAsJA8AOAPGgAgsS4AUHUNABA+EQA=
atoms_y: AAAAAAAAAABwFREAcBURAKC5BQAAkQUAYHobACD5CQA=
atoms_z: AAAAAAAAAABAQg8AQEIPAEBCDwBAQg8AQEIPALAqAgA=
atoms_occupancy: wA03AED7BQBAXjQAwKoIAAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_aniso_u11: 0DMBANAzAQBQiwEAUIsBAECDAADQzwAAYE4BAIA4AQA=
atoms_aniso_u22: YP0BAGD9AQBwQwEAcEMBAHAqAQCwrQEAUMMAAEBkAQA=
atoms_aniso_u33: 4CgBAOAoAQCwlAEAsJQBAMDaAABASwEAEGwBAABFAQA=
atoms_aniso_u12: EMP//xDD///AKwAAwCsAAGAiAADgFQAAcP7//7AEAAA=
atoms_aniso_u13: sNL//7DS//8AAAAAAAAAAAAAAAAAAAAAAAAAAPDx//8=
atoms_aniso_u23: ALX//wC1//8AAAAAAAAAAAAAAAAAAAAAAAAAACBnAAA=
pub_title:
 High-temperature Fe-Mg cation partitioning in olivine: In-situ single-crystal
 neutron diffraction study
 T = 960 C
 Atomic parameters obtained from the ICSD

qdat:
AAAAAAAAAAAAAAAAAAAAYAAAAAAAgBAAAAGgAAAAUoIBARAQIIAYAsAA1LAFpAQCQQAgRcgwLsG1IwBYIQyslRIN6M7LpxFmWT9YsfzDQ4v4crXTp77VyhZ09F3dv9DZoX+P3eYZ6rfk3a6bs+x+j7L9nfa6nP31fS3u23==


formula: (Mg1.76 Fe.24) Si O4
compound: <missing>
formula_title: <missing>
a: 4.772
b: 10.35
c: 6.053
alpha: 90
beta: 90
gamma: 90
cell_volume: 298.959
crystal_density: 3.294
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAAAwhDwAMIQ8AEAZGgAQoy4AEIgNAEA2EQA=
atoms_y: AAAAAAAAAABAHREAQB0RAFC+BQBQjAUAsI4bALD6CQA=
atoms_z: AAAAAAAAAABAQg8AQEIPAEBCDwBAQg8AQEIPAPAwAgA=
atoms_occupancy: 4Fs3ACCtBQAgEDQA4PgIAAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_aniso_u11: cI4BAHCOAQAw0wEAMNMBAMCoAABg6gAAsHsBAHCOAQA=
atoms_aniso_u22: oLgBAKC4AQBwEQEAcBEBANAaAQBwKgEAwKgAANABAQA=
atoms_aniso_u33: 8DYBAPA2AQDAogEAwKIBANABAQDAcAEAYJkBAHBcAQA=
atoms_aniso_u12: EKr//xCq//9QFAAAUBQAABAnAADgFQAAoA8AANAHAAA=
atoms_aniso_u13: EMP//xDD//8AAAAAAAAAAAAAAAAAAAAAAAAAALDr//8=
atoms_aniso_u23: YKX//2Cl//8AAAAAAAAAAAAAAAAAAAAAAAAAAOB5AAA=
pub_title:
 High-temperature Fe-Mg cation partitioning in olivine: In-situ single-crystal
 neutron diffraction study
 T = 1030 C
 Atomic parameters obtained from the ICSD

qdat:
AAAAAAAAAAAAAAAAAAAAwAAAAAAAgCAAAAGgAAAAkwQBAiAQYQAoBMABZLAHSAQCgQBgz5BgnYMqRgCQYhlZHSIZsd2ejSO0un6RQenHhifw6bMvTX01nEzq2Nv/dSO2hX4ep0p2+f5fW106R1j5P3f3r/0l69/V6nfr38==


formula: (Mg1.76 Fe.24) Si O4
compound: <missing>
formula_title: <missing>
a: 4.770
b: 10.380
c: 6.070
alpha: 90
beta: 90
gamma: 90
cell_volume: 300.541
crystal_density: 3.277
atoms_sites: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAACwqTwAsKk8AFAOGgCAoS4A4HYNAGAgEQA=
atoms_y: AAAAAAAAAACQ/xAAkP8QAPDNBQDgpgUAkIsbAIDpCQA=
atoms_z: AAAAAAAAAABAQg8AQEIPAEBCDwBAQg8AQEIPABA0AgA=
atoms_occupancy: QMk3AMA/BQDAojMAQGYJAAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Mg1", "Fe1", "Mg2", "Fe2", "Si", "O1", "O2", "O3"]
atoms_aniso_u11: AJABAACQAQBwVgIAcFYCAHCUAADAPgEAsMYBAIAfAQA=
atoms_aniso_u22: AFgCAABYAgDAPgEAwD4BAFAOAQAQngEAQGoAAGDLAQA=
atoms_aniso_u33: wNQBAMDUAQCgZwIAoGcCALDlAABg5AEAEDQCAOBUAgA=
atoms_aniso_u12: AGQAAABkAAAQw///EMP//4AMAABgIgAAgNr//2AJAAA=
atoms_aniso_u13: 4OP//+Dj//8AAAAAAAAAAAAAAAAAAAAAAAAAAPDx//8=
atoms_aniso_u23: EMP//xDD//8AAAAAAAAAAAAAAAAAAAAAAAAAAFCRAAA=
pub_title:
 High-temperature Fe-Mg cation partitioning in olivine: In-situ single-crystal
 neutron diffraction study
 T = 1060 C
 Atomic parameters obtained from the ICSD

qdat:
AAAAAAAAAAAAAAAAAAAAwAAAAAABACAAAAFAAAAApQQBAiAQYgBICYAByWAKkAgFAgDBTyBhKwN9BgEwqFPRdIRVIl07FktpXPZShduNHHfjl3o+X+5/dJWv0b20+qt3FXh2z6P73f5n82h/H+3TW+f2bpun397Vs63e/5==


formula: Ca4.497 Na.178 La.325 (P2.856 Si.144) O12 F
compound: <missing>
pub_title: Site preference of rare earth elements in fluorapatite Sample: La-FAp
formula_title: <missing>
a: 9.4123
b: 9.4123
c: 6.9080
alpha: 90
beta: 90
gamma: 120
cell_volume: 529.998
crystal_density: 3.340
atoms_sites: ["Ca1", "Na1", "La1", "Ca2", "La2", "P", "Si", "O1", "O2", "O3", "F"]
atoms_x: q7AoAKuwKACrsCgACGs8AAhrPABQhRYAUIUWAHCVHQDwdRwAgKwPAAAAAAA=
atoms_y: VVgUAFVYFABVWBQA0KgOANCoDgAATBgAAEwYAEDyEwAA1yMA4MkUAAAAAAA=
atoms_z: YAkAAGAJAABgCQAAQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AwF4EAEBCDwA=
atoms_occupancy: ADM2AKBuBQBgZwEA4Fs3ACCtBQAAGzoAAO4CAAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: OK4AADiuAAA4rgAAEJ8AABCfAABoagAAaGoAANjHAAB46wAACBUBAJhbAgA=
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:
AAAAAAAAAAAABAAAAAABAAQAACAgABIAAggAASECAIAAEEIoCgCIQFAIhAhCDAgCVByAmGAlQYIQJiWmxDFhViABJlczKDsigkxIr3hxVQZStVbKptc7irTexOldxJ2ukbuTkvfs71fprj1fZVyXd4Z23Psrft+wtTT8My==


formula: Ca4.331 Na.257 Nd.409 (P2.841 Si.159) O12 F
compound: <missing>
pub_title: Site preference of rare earth elements in fluorapatite Sample: Nd-FAp
formula_title: <missing>
a: 9.3979
b: 9.3979
c: 6.8997
alpha: 90
beta: 90
gamma: 120
cell_volume: 527.743
crystal_density: 3.410
atoms_sites: ["Ca1", "Na1", "Nd1", "Ca2", "Na2", "Nd2", "P", "Si", "O1", "O2", "O3", "F"]
atoms_x: q7AoAKuwKACrsCgAgHA8AIBwPACAcDwA8IAWAPCAFgDgeh0A0HIcAJChDwAAAAAA
atoms_y: VVgUAFVYFABVWBQASLMOAEizDgBIsw4A8EIYAPBCGADQ2hMAsMIjAODJFAAAAAAA
atoms_z: AAAAAAAAAAAAAAAAQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAKBbBABAQg8A
atoms_occupancy: IP42ACC5AwDAUQIA4HMzACC/AgBgxgYA4Mw5ACA8AwAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: GLAAABiwAAAYsAAAcJQAAHCUAABwlAAA+GYAAPhmAAAAvgAAcPMAAAgVAQDgRQIA
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:
AAAAAAAAAAAABAAAAAABAAIAACAgABIAAggAAKCBAEAAECIoBQCEICgERAQjDAgDKg5AWCASoUEIExLVZBCwrTAAkys6pD6hQSZkXbwoqoMpOqtnU2udxppv4miWYnXfyNqtySb+V5a81puz8l1LV6K3vZOf3e/0Ond/HZ==


formula: (Ca4.52 Na.173 Gd.307) (P2.859 Si.141) O12 F
compound: <missing>
pub_title: Site preference of rare earth elements in fluorapatite Sample: Gd-FAp
formula_title: <missing>
a: 9.3853
b: 9.3853
c: 6.8876
alpha: 90
beta: 90
gamma: 120
cell_volume: 525.406
crystal_density: 3.394
atoms_sites: ["Ca1", "Na1", "Gd1", "Ca2", "Na2", "Gd2", "P", "Si", "O1", "O2", "O3", "F"]
atoms_x: q7AoAKuwKACrsCgA8Ic8APCHPADwhzwAkHwWAJB8FgBAhB0A4IAcAACgDwAAAAAA
atoms_y: VVgUAFVYFABVWBQAUMkOAFDJDgBQyQ4AqD8YAKg/GACw1xMAkNgjAODJFAAAAAAA
atoms_z: KAUAACgFAAAoBQAAQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPALBQBABAQg8A
atoms_occupancy: wBM2AICjBADAUQIAgOg3AGBtAAAgswQAoCo6AGDeAgAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: SJ4AAEieAABIngAAMH8AADB/AAAwfwAACFwAAAhcAAAQuAAAwNUAADABAQDg5gEA
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:
AAAAAAAAAAAABAAAAAAAgAIAABAgABIAAggAAKCBAEAACCEYBQBEICgEQgQhBgQBFQ4gTDASoMCEEopTMhholpgASpWdVA9QwJMSLtosVUGUrVWzqbXG4s0z8SpXaTfrpH22ZP17q3P+V4k3eT+3+fFO77WnZXP6Fy/fja==


formula: Ca4.584 Na.158 Dy.258 P2.874 Si.12 O12 F
compound: <missing>
pub_title: Site preference of rare earth elements in fluorapatite Sample: Dy-FAp
formula_title: <missing>
a: 9.3784
b: 9.3784
c: 6.8832
alpha: 90
beta: 90
gamma: 120
cell_volume: 524.298
crystal_density: 3.374
atoms_sites: ["Ca1", "Na1", "Dy1", "Ca2", "Dy2", "P", "Si", "O1", "O2", "O3", "F"]
atoms_x: q7AoAKuwKACrsCgAkJI8AJCSPAAYfBYAGHwWAGCHHQBQfxwAkKEPAAAAAAA=
atoms_y: VVgUAFVYFABVWBQAiNIOAIjSDgAAQhgAAEIYAEDZEwAg2iMAAM0UAAAAAAA=
atoms_z: qAcAAKgHAACoBwAAQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8A8FYEAEBCDwA=
atoms_occupancy: QNU1AGDSBABgYQIAgF85AICpAwDAeDoAAHECAAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: aJwAAGicAABonAAAkHkAAJB5AADwVQAA8FUAADiuAADYxwAAgOMAAEDDAQA=
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:
AAAAAAAAAAAABAAAAAAAgAIAABAgAAkAAgQAAKCBAEAACCEUAwBEIBgEQgQhBgQBFQ0gTBgJYMCEEYlpMgxYVYgASZXM0g7QYNEaLb4UTUDcnVWTnatn0q87+LotuJW39Drycl7bmdv9VcebrK+b/fDN+5tj5tn1CqXfx3==


formula: Mn1.85 Mg.106 Al.012 Fe.008 Ca.008 Si O6 H4
compound: N'chwaning mine, South Africa
formula_title: <missing>
a: 12.672
b: 7.217
c: 5.341
alpha: 90
beta: 90
gamma: 90
cell_volume: 488.455
crystal_density: 3.174
atoms_aniso_u11: cK0AAHCtAABwrQAAcK0AAHCtAADAqAAAwKgAAMCoAADAqAAAwKgAABCLAACwzAAA0LYAAHD4AAAwCwEAgKIAABDvAAA=
atoms_aniso_u22: kLAAAJCwAACQsAAAkLAAAJCwAABguAAAYLgAAGC4AABguAAAYLgAAOB5AABwewAA8LkAAAB9AAAgywAAQLUAAKClAAA=
atoms_aniso_u33: ILMEACCzBAAgswQAILMEACCzBABAgwAAQIMAAECDAABAgwAAQIMAAOB5AACgjAAAMMAAAHDGAAAgywAAQM4AAAB9AAA=
atoms_aniso_u12: IAMAACADAAAgAwAAIAMAACADAADgFQAA4BUAAOAVAADgFQAA4BUAALAEAADQBwAAsAQAAFDi//9gCQAAUBQAAFAUAAA=
atoms_aniso_u13: sAQAALAEAACwBAAAsAQAALAEAAAw+P//MPj//zD4//8w+P//MPj//5ABAADA+f//oPb//2AJAADAx///8PH//zDf//8=
atoms_aniso_u23: oA8AAKAPAACgDwAAoA8AAKAPAABw/v//cP7//3D+//9w/v//cP7//+D8///A+f//MBEAADD4//+A8///sAQAAADn//8=
pub_title:
 Nchwaningite, Mn2SiO3(OH)2.H2O, a new pyroxene-related chain silicate from the
 N'chwaning mine, Kalahari manganese field, South Africa

atoms_sites:
["Mn1", "Mg1", "Al1", "Fe1", "Ca1", "Mn2", "Mg2", "Al2", "Fe2", "Ca2", "Si", "O1", "O-h2", "O-h3", "O-h4", "O5", "O6", "H2", "H3", "H4", "H41"]

atoms_x:
OHsLADh7CwA4ewsAOHsLADh7CwAIdzoACHc6AAh3OgAIdzoACHc6AFCwMQAw3zEAoIE4ALBsKQCwuzkAEJk4AFDbLgCgxTUAoJApAAAhOQCAyjwA

atoms_y:
SD8yAEg/MgBIPzIASD8yAEg/MgDwSwoA8EsKAPBLCgDwSwoA8EsKANDx8v+QlwAAkAf//6BlEwCg3BQAQC3t/5Cf7v/gWPn/gJYbAADPHABAoRQA

atoms_z:
AAAAAAAAAAAAAAAAAAAAAAAAAABAqP7/QKj+/0Co/v9AqP7/QKj+/9B0CwDQkwoA4Pfr/7ADFQCAXBQAYBkOAPCS+v/Axi0A4KoVAAAREgDArxwA

atoms_occupancy:
IHU4ACA8AwDAXQAAgD4AAIA+AAAgdTgAIDwDAMBdAACAPgAAgD4AAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegCAOAEAgDgBAIA4AQCAOAEA

atoms_aniso_label:
["Mn1", "Mg1", "Al1", "Fe1", "Ca1", "Mn2", "Mg2", "Al2", "Fe2", "Ca2", "Si", "O1", "O-h2", "O-h3", "O-h4", "O5", "O6"]

qdat:
AAAAAAAAAAAAAAAAGAAAAAgAACAACkQAAoBAwAWQAhHFogEA3EUOAJSIAEjyrRBWjExOBm0a8vJjLsNRYM/nw7Y1vj1UL+rV7Tf43v3ltfve//5/Rrvw/f/bq3/7en9b/qf/cmd+qv/6959P8p77dT927pe/R3PN/sz+X/==


formula: Al2.45 Li.955 Si1.015 B.56 O9 H4
compound: <missing>
pub_title: The crystal structure of manandonite-2H2
formula_title: <missing>
a: 5.070
b: 8.776
c: 13.778
alpha: 90.09
beta: 90.12
gamma: 89.97
cell_volume: 613.041
crystal_density: 2.766
atoms_u_iso: 0
atoms_sites:
["Al1", "Li1", "Al2", "Li2", "Al3", "Li3", "Si1", "Al4", "B1", "Si2", "Al2", "B2", "O1", "O2", "O3", "O4", "O5", "O-h1", "O-h2", "O-h3", "O-h4", "Al11", "Li11", "Al22", "Li22", "Al33", "Li33", "Si11", "Al11", "B11", "Si22", "Al22", "B22", "O11", "O22", "O33", "O44", "O55", "O-h11", "O-h22", "O-h33", "O-h44", "H1", "H2", "H3", "H4", "H11", "H22", "H33", "H44"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_aniso_label:
["Al1", "Li1", "Al2", "Li2", "Al3", "Li3", "Si1", "Al4", "B1", "Si2", "Al2", "B2", "O1", "O2", "O3", "O4", "O5", "O-h1", "O-h2", "O-h3", "O-h4", "Al11", "Li11", "Al22", "Li22", "Al33", "Li33", "Si11", "Al11", "B11", "Si22", "Al22", "B22", "O11", "O22", "O33", "O44", "O55", "O-h11", "O-h22", "O-h33", "O-h44"]

atoms_aniso_u11:

atoms_aniso_u22:

atoms_aniso_u33:

atoms_aniso_u12:

atoms_aniso_u13:

atoms_aniso_u23:

qdat:
AAAAAAACAAAAgAQQAAAICAhBAiAAIAJEGgAhDAjhAIkrgiAyKEQM2wWUTUoKZjnXcor0UsTOl1U48p3CnVqnhzrvQp7rZW//qP5Vax7t/98fvf7KO/h/rvnu8e7V3//7Z/qrfq/uv/63XO2bHv/vc/9W29+Pu9qsltYk+b==


formula: Tl As3.89 Sb.11 S6.5
compound: <missing>
formula_title: <missing>
a: 9.584
b: 5.679
c: 21.501
alpha: 90
beta: 100.07
gamma: 90
cell_volume: 1152.219
crystal_density: 4.137
atoms_x: YHMxAPCQCwDA4RwAMMoPANDjBQBQTDEAUEwxAPBbMQDwWzEAkPMSAEBhJwBAvBwAsNwOAED7BQDA6TwAgIMzAA==
atoms_y: MOE5AFDjNQCASxsAkPw2AMBRGwAw3AwAMNwMABBjKAAQYygAgK4XACCsGgBA4TMAYCQhAIAANABAfRoAIG85AA==
atoms_z: ABUJAFDNDwCwYwUAUEABALBjBQBg0wgAYNMIAMD1CADA9QgA8GoJANAQCwDAWAUAkNX+/3BdBQCwDQsA4MENAA==
atoms_occupancy: gIQeAICEHgAACT0AAAk9AAAJPQDAPhoAwEUEAIATHAAAcQIAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AgIQeAA==
atoms_u_iso: 0
atoms_aniso_u11: 4CICAEDvBwBAnAAA4CgBAOCrAABg6gAAYOoAAKAJAQCgCQEAoIwAAGDqAADgKAEAYGcBAIC1AQCAuwAAgLUBAA==
atoms_aniso_u22: 4CICAIAsAwAgywAAoIYBAMDaAAAA+gAAAPoAAMDaAADA2gAAoIYBAAB3AQDA2gAAgCwDAGBnAQDgpQEA4CgBAA==
atoms_aniso_u33: QAcEACChBwAgSAEAIMUBAGBnAQAA+gAAAPoAAGDqAABg6gAAwNQBAEAZAQDgHAMAQBkBAGDkAQBAGQEAIMsAAA==
atoms_aniso_u12: gMH//2Bz//+gDwAA4C4AAAAAAACgDwAAoA8AAMDg///A4P//QB8AAKAPAACAwf//IE4AAKAPAACAwf//YG0AAA==
atoms_aniso_u13: AHcBAOBM+//wIwAAAH0AANBrAAAAfQAAAH0AAMBdAADAXQAAYG0AAKCMAACgDwAAQJwAACDLAACgjAAAIE4AAA==
atoms_aniso_u23: AIP//4DB//9AHwAAwNoAAKAPAABAHwAAQB8AAEAfAABAHwAAoIwAAMDg//8AAAAAgMH//8Dg//8AAAAAoA8AAA==
pub_title:
 The crystal structure of gillulyite, Tl2(As,Sb)8S13, from the Mercur gold
 deposit, Tooele County, Utah, U.S.A

atoms_sites:
["Tl1", "Tl2", "As1", "As2", "As3", "As4", "Sb1", "As5", "Sb2", "S1", "S2", "S3", "S4", "S5", "S6", "S7"]

atoms_aniso_label:
["Tl1", "Tl2", "As1", "As2", "As3", "As4", "Sb1", "As5", "Sb2", "S1", "S2", "S3", "S4", "S5", "S6", "S7"]

qdat:
AAAAAAAAABAQAAAAQAERAkUCMBAwBClCQMQgJQ021Dpj4kDY+3GXlkVe7PnnfmrH/Z38ux92yn7v//aX1ma+j97dbHv+//J/3v07939vW/9/f7n/N+e1+/7/fR+9/tN42X+/9/7/3Pe9/NPQe+u3/eO9vP3+bd/Tojd9VM==


formula: As S
compound: <missing>
pub_title: The crystal structure of pararealgar
formula_title: <missing>
a: 9.909
b: 9.655
c: 8.502
alpha: 90
beta: 97.29
gamma: 90
cell_volume: 806.823
crystal_density: 3.523
atoms_sites: ["As1", "As2", "As3", "As4", "S1", "S2", "S3", "S4"]
atoms_x: sHMTALD/BAAgkhYAcOEIAFAKCgAQfA8AcLQcAMD8CwA=
atoms_y: sMkmALAfIQDwAxYAcP0UALDdKwDgLx0AwDMgALBcGwA=
atoms_z: AKMCAEDZEwDw8BQAMAcKALC8CwAwHx8AAGENAED//P8=
atoms_occupancy: 0
atoms_u_iso: wFECAOAiAgBADQMAoIACAABxAgDAzgIAgCwDAECQAgA=
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:
AAAAAAAAAACAAAAQEAAAEKABRgARQAIAghTCJIDAAnDYyWGToGzDwbYOc8Iqd8O5p5wPO682+FW+2r/X5tu/+Z93+e/+/9e/f/5+/3/9/efX/////3//+939/+7e/7/bf///+73/v//+Xfv3//b7d/et/+P3722fPn/B5Z==


formula: Ti.96 Nb.011 Cr.012 Al.011 Fe.008 O2 H.108
compound: <missing>
formula_title: <missing>
a: 4.587
b: 4.587
c: 2.954
alpha: 90
beta: 90
gamma: 90
cell_volume: 62.154
crystal_density: 4.299
atoms_sites: ["Ti", "Nb", "Cr", "Al", "Fe", "O", "H"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAADQlRIAgKIZAA==
atoms_y: AAAAAAAAAAAAAAAAAAAAAAAAAADQlRIAgIQeAA==
atoms_z: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
atoms_occupancy: AJg6AOCrAACAuwAA4KsAAAB9AAAACT0A4KUBAA==
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAQHcbAA==
atoms_aniso_label: ["Ti", "Nb", "Cr", "Al", "Fe", "O"]
atoms_aniso_u11: YAkAAGAJAABgCQAAYAkAAGAJAADAKwAA
atoms_aniso_u22: YAkAAGAJAABgCQAAYAkAAGAJAADAKwAA
atoms_aniso_u33: 0AcAANAHAADQBwAA0AcAANAHAADgLgAA
atoms_aniso_u12: 8PH///Dx///w8f//8PH///Dx//+Q6P//
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
pub_title:
 H in rutile-type compounds: I. Single-crystal neutron and X-ray diffraction
 study of H in rutile
 Sample: neutron; natural, T = 24 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAQAACAAgAAgAAAAAAAAAAQAEAAAAABAQCAAAQgAIAIAIAAIACAIAAQBBAAACQgQAAAAjAAQAAQCIBgEgCBAIAEAkQAAAQsAIhAgABgJIEQICgLAAQIBgSAQBEECkQ==


formula: Ti.91 Al.08 Nb.01 Cr.01 O2
compound: <missing>
formula_title: <missing>
a: 4.5940
b: 4.5940
c: 2.9586
alpha: 90
beta: 90
gamma: 90
cell_volume: 62.441
crystal_density: 4.211
atoms_sites: ["Ti", "Al", "Nb", "Cr", "O"]
atoms_x: AAAAAAAAAAAAAAAAAAAAANicEgA=
atoms_y: AAAAAAAAAAAAAAAAAAAAANicEgA=
atoms_z: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_occupancy: wIo3AADiBABAnAAAQJwAAAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Ti", "Al", "Nb", "Cr", "O"]
atoms_aniso_u11: gHAAAIBwAACAcAAAgHAAABBZAAA=
atoms_aniso_u22: gHAAAIBwAACAcAAAgHAAABBZAAA=
atoms_aniso_u33: UEYAAFBGAABQRgAAUEYAAMBEAAA=
atoms_aniso_u12: wP7//8D+///A/v//wP7//wjf//8=
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
pub_title:
 H in rutile-type compounds: I. Single-crystal neutron and X-ray diffraction
 study of H in rutile
 Sample: X-ray; natural, T = 300 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAQAACABAAAgAAAAAAAAAAgAEAAAAABAgEAAAhAAIAQAQAAQAEAQAAgBCAAAEgggAAAAmAAgAAgEQDAJAEBAQAICIgAAAiQAiECAAHASQQgQGAWABAgCBEBAEQYKIh==


formula: Ti.992 O2
compound: <missing>
formula_title: <missing>
a: 4.5922
b: 4.5922
c: 2.9574
alpha: 90
beta: 90
gamma: 90
cell_volume: 62.367
crystal_density: 4.233
atoms_sites: ["Ti", "O"]
atoms_x: AAAAAACdEgA=
atoms_y: AAAAAACdEgA=
atoms_z: AAAAAAAAAAA=
atoms_occupancy: AIw8AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Ti", "O"]
atoms_aniso_u11: kGoAAGBUAAA=
atoms_aniso_u22: kGoAAGBUAAA=
atoms_aniso_u33: IE4AAHBJAAA=
atoms_aniso_u12: IP7//4jm//8=
atoms_aniso_u13: AAAAAAAAAAA=
atoms_aniso_u23: AAAAAAAAAAA=
pub_title:
 H in rutile-type compounds: I. Single-crystal neutron and X-ray diffraction
 study of H in rutile
 Sample: X-ray; synthetic, T = 300 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAQAACABAAAgAAAAAAAAAAgAEAAAAABAQEAAAhAAIAQAQAAQAEAQAAgBCAAAEgggAAAAmAAgAAgEIDAIgEBAYAIBIgAAAiYARCCAADASIIgYFAOAAggDAkAgCQYFEQ==


formula: Si O2
compound: <missing>
formula_title: <missing>
a: 4.1839
b: 4.1839
c: 2.6684
alpha: 90
beta: 90
gamma: 90
cell_volume: 46.710
crystal_density: 4.272
atoms_sites: ["Si", "O"]
atoms_x: AAAAAMCgEgA=
atoms_y: AAAAAMCgEgA=
atoms_z: AAAAAAAAAAA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "O"]
atoms_aniso_u11: UHgAABCLAAA=
atoms_aniso_u22: UHgAABCLAAA=
atoms_aniso_u33: EA4AAJABAAA=
atoms_aniso_u12: YAkAAJAaAAA=
atoms_aniso_u13: AAAAAAAAAAA=
atoms_aniso_u23: AAAAAAAAAAA=
pub_title:
 H in rutile-type compounds: II. Crystal chemistry of Al substitution in
 H-bearing stishovite
 Sample: aluminous

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAEAAAgABAAAgAAAAAAAAAAAIABAAAAAAAEQAgAACAQAIAQAAQAAEAEAQAAQACQAAAIFAQAAAACCIABAAQASACIQgEBACIAEIEgAAAhBIBQQQAAAkwKAIhEQCh==


formula: Si O2
compound: <missing>
formula_title: <missing>
a: 4.1773
b: 4.1773
c: 2.6652
alpha: 90
beta: 90
gamma: 90
cell_volume: 46.507
crystal_density: 4.291
atoms_sites: ["Si", "O"]
atoms_x: AAAAALCrEgA=
atoms_y: AAAAALCrEgA=
atoms_z: AAAAAAAAAAA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "O"]
atoms_aniso_u11: 4BUAACAcAAA=
atoms_aniso_u22: 4BUAACAcAAA=
atoms_aniso_u33: 0CAAAMArAAA=
atoms_aniso_u12: kAEAAPDx//8=
atoms_aniso_u13: AAAAAAAAAAA=
atoms_aniso_u23: AAAAAAAAAAA=
pub_title:
 H in rutile-type compounds: II. Crystal chemistry of Al substitution in
 H-bearing stishovite
 Sample: pure-silica

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAACAAAQAAgAAgAAAAAAAAAAAEABAAAAAAAEIAgAABAQAEAIAAQAAEAEAIAAIABIAAAECQIAAAABBEAAQAIAJABEIQCAgBEABCBgAAAQREAoIEAAARUCAEgSIAw==


formula: Si3 Al2 Mg3 O12
compound: <missing>
pub_title: X-ray single-crystal diffraction study of pyrope in the temperature range 30-973 K T = 30 K
formula_title: <missing>
a: 11.439
b: 11.439
c: 11.439
alpha: 90
beta: 90
gamma: 90
cell_volume: 1496.801
crystal_density: 3.578
atoms_sites: ["Si", "Al", "Mg", "O"]
atoms_x: YOMWAAAAAAAAAAAAOAICAA==
atoms_y: AAAAAAAAAABAQg8ACBgDAA==
atoms_z: QEIPAAAAAAAgoQcA+N8nAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Al", "Mg", "O"]
atoms_aniso_u11: cBcAAGAdAABQQQAAUC0AAA==
atoms_aniso_u22: oB4AAGAdAABQQQAAUDcAAA==
atoms_aniso_u33: oB4AAGAdAADIKAAAMCUAAA==
atoms_aniso_u12: AAAAALD///+4CwAAoAUAAA==
atoms_aniso_u13: AAAAALD///8AAAAAAPb//w==
atoms_aniso_u23: AAAAALD///8AAAAAyAAAAA==
qdat:
AAAAAAAAAAAAAAAAAAAAAAEAABAAAAAAAAQACAAAAgAgBACAAAQBAAAAEBAIAAgICAgIEAAAgQIEECBABBAAhBBACCCEEIIAgCEIIQCEAAhEIRCARCAQAIiIBABEAAREBEAIAAEAAABAAAAAAAAASAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 Mg3 O12
compound: <missing>
pub_title: X-ray single-crystal diffraction study of pyrope in the temperature range 30-973 K T = 300 K
formula_title: <missing>
a: 11.4544
b: 11.4544
c: 11.4544
alpha: 90
beta: 90
gamma: 90
cell_volume: 1502.855
crystal_density: 3.563
atoms_sites: ["Si", "Al", "Mg", "O"]
atoms_x: YOMWAAAAAAAAAAAA2AICAA==
atoms_y: AAAAAAAAAABAQg8AQBIDAA==
atoms_z: QEIPAAAAAAAgoQcAcOAnAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Al", "Mg", "O"]
atoms_aniso_u11: qCoAABA2AABwqAAAmE4AAA==
atoms_aniso_u22: MDkAABA2AABwqAAAgGEAAA==
atoms_aniso_u33: MDkAABA2AAC4TAAAGD0AAA==
atoms_aniso_u12: AAAAANj///8oMgAAwA0AAA==
atoms_aniso_u13: AAAAANj///8AAAAA4O3//w==
atoms_aniso_u23: AAAAANj///8AAAAACP3//w==
qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABABACAAAgCAAAAIBAQAAgICAgQEAAAgQIIECCACBABBCCACEEIIQQBACEIQgCEABCEQiEAiEBAAhEQEACIAAiICIAQAAIAAACAAAAAAAABEAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 Mg3 O12
compound: <missing>
pub_title: X-ray single-crystal diffraction study of pyrope in the temperature range 30-973 K T = 773 K
formula_title: <missing>
a: 11.5129
b: 11.5129
c: 11.5129
alpha: 90
beta: 90
gamma: 90
cell_volume: 1525.999
crystal_density: 3.509
atoms_sites: ["Si", "Al", "Mg", "O"]
atoms_x: YOMWAAAAAAAAAAAAkAQCAA==
atoms_y: AAAAAAAAAABAQg8AeAcDAA==
atoms_z: QEIPAAAAAAAgoQcAAOInAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Al", "Mg", "O"]
atoms_aniso_u11: kGAAAKh/AAAYlgEAeLQAAA==
atoms_aniso_u22: UIcAAKh/AAAYlgEAqOMAAA==
atoms_aniso_u33: UIcAAKh/AAB4tAAAgIkAAA==
atoms_aniso_u12: AAAAAFAAAABAbwAA+CAAAA==
atoms_aniso_u13: AAAAAFAAAAAAAAAAONL//w==
atoms_aniso_u23: AAAAAFAAAAAAAAAA4Pf//w==
qdat:
AAAAAAAAAAAAAAAAAAAAAAIAACAAAAAAAAgAIAAACACAEAIAABAEAAAAgEAgACAgICBAQAACBBAgQQIAIIAIIIIAQQghBCAIAQhCEAggAIhCIRAIRAIAERCAgAiAAIiAiAEAACAAABAAAAAAAAAJAAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 Mg3 O12
compound: <missing>
pub_title: X-ray single-crystal diffraction study of pyrope in the temperature range 30-973 K T = 973 K
formula_title: <missing>
a: 11.5348
b: 11.5348
c: 11.5348
alpha: 90
beta: 90
gamma: 90
cell_volume: 1534.724
crystal_density: 3.489
atoms_sites: ["Si", "Al", "Mg", "O"]
atoms_x: YOMWAAAAAAAAAAAAQAQCAA==
atoms_y: AAAAAAAAAABAQg8AMAQDAA==
atoms_z: QEIPAAAAAAAgoQcAkOMnAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Al", "Mg", "O"]
atoms_aniso_u11: GHkAABihAACI+AEAaOIAAA==
atoms_aniso_u22: GHkAABihAACI+AEAQBkBAA==
atoms_aniso_u33: GHkAABihAABg4AAAqKwAAA==
atoms_aniso_u12: AAAAAGD///8AjAAA6CYAAA==
atoms_aniso_u13: AAAAAGD///8AAAAACMb//w==
atoms_aniso_u23: AAAAAGD///8AAAAAqPj//w==
qdat:
AAAAAAAAAAAAAAAAAAAAAAQAACAAAAAAAAgAIAAACAEAEAIAACAIAAAAgEBAACBAQECAgAAECBBAggQAQQAQQQQAghBCEEAQAhCEIBCAAhCEQiARCAQAIiICABEAARECIAIAAEAAACAAAAAAAAAkAAAAAAAAAAAAAAAAAA==


formula: Mn P2 Al O15 H15
compound: Barker pegmatite, near Keystone, Pennington County, South Dakota, USA
pub_title: The crystal structure of sinkankasite, a complex heteropolyhedral sheet mineral
formula_title: <missing>
a: 9.590
b: 9.818
c: 6.860
alpha: 108.04
beta: 99.63
gamma: 98.87
cell_volume: 590.695
crystal_density: 2.243
atoms_occupancy: 0
atoms_sites:
["Mn", "P1", "P2", "Al1", "Al2", "O1", "O2", "O3", "O4", "O5", "O6", "O-h1", "O-h2", "O-h3", "OW1", "OW2", "OW3", "OW4", "OW5", "OW6", "H1", "H2", "H3", "H4", "H5", "H6", "H7", "H8", "H9", "H10", "H11", "H12", "H13", "H14", "H15"]

atoms_x:
8J4RADAiEgAgyREAgIQeAICEHgCwsREA0NsXAEA3FQCQihcAIBsVACABEQCwUQgAUFUjAPA+CADwGxIAIKcfACDiEQBQfwMAIBcFANB2+v9AeAYAwGEpAGDYAwDgIRcAQLMRAGASJACAZiMAIDsYAACUEQBg6gAAAAAAAOB7CACg8QQAgPf2/yDp+/8=

atoms_y:
ABs6AGATKABgqQ8AgIQeAICEHgDAxzEAoDgnAJDYIwBQ7RIAIDQVAKC5BQDACCMAUIYfAKA/EQBQ2y4AgD4AAFCTCADwPTYAIBE4AMA0JADArxwA4GIhAKDHCwCg+ywA4LUoAGBVBABgf/3/AMQJAKA4DgCg6S8A4Mw5AEBeNADA6TwAYCogAMAgHwA=

atoms_z:
0KEpAODnDwDgVQYAgIQeAAAAAADgDhYAMB8GADDAGQAw5BMAoJj+/5CmPADgxggAENoQABB6BwBwIzAAwFwuAGBjIwBAcyQA0FQIACBOGQCgdAQAYGwVAGBbAwCAKi0AwFUrAICtLABA5zIAIGolAIBCKQCgQyEA4DIpAEBaCwDgzg8AoGEcAGB4EwA=

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegDA1AEAwNQBAMDUAQDA1AEAwNQBAMDUAQDA1AEAwNQBAMDUAQDA1AEAwNQBAMDUAQDA1AEAwNQBAMDUAQA=

atoms_aniso_label:
["Mn", "P1", "P2", "Al1", "Al2", "O1", "O2", "O3", "O4", "O5", "O6", "O-h1", "O-h2", "O-h3", "OW1", "OW2", "OW3", "OW4", "OW5", "OW6"]

atoms_aniso_u11:
AHcBAKAiAQAwJAEA0OgAAOAoAQCAAAIAgOcBAJBfAQDQlwEA0MkBAPDMAQCwSQEA4CgBAKCGAQAQFQMAcI4BAFBsAgCwxgEAAJABALAFBAA=

atoms_aniso_u22:
gB8BAJD7AABAzgAAMMAAAPDSAAAALAEAsGIBAKA7AQDA8wAA8B0BAMAMAQBw2QEAABMBAABeAQAgrAEAQCwCAIBqAQAgKQIAsN8BAOBOAwA=

atoms_aniso_u33:
8DwAABBAAABgOwAAkAEAAJABAACAcAAA8CMAAGAiAAAQQAAAAEsAAMB2AAAAdwEAkAEAAADIAADQtgAAICkCAKBaAABA4QEAIC8BAMDIAwA=

atoms_aniso_u12:
sE8AADBcAACwHQAA4C4AACBOAACQsAAAgKIAAHBiAACwBAAA0CAAANBSAADwPAAA8DwAADD4//8w8gAAoFoAAPAjAACQfgAA0FIAAIDa//8=

atoms_aniso_u13:
YFQAABBAAACAPgAAoCgAAJBMAAAAfQAAkJcAAJBMAABQLQAA8DwAACBnAABw/v//QDgAAEBRAAAAyAAA8G4AALBPAAAQvQAAoCgAAOBaAQA=

atoms_aniso_u23:
kGUAABByAACgWgAAgFcAAJBlAABwewAAEKQAACCZAACAcAAAYJ8AAFB4AABQwwAAoHMAAHBiAAAQvQAAsMYBAPBuAACwswAAkOIAAEBLAQA=

qdat:
AAAAAAAAAAAMAAAAEBAAAAiwAAADIAAgCgkCEIOAAQBgUY4IAWEBEWkaJHEkIsjiU55AR8JdO6eEUyKtHIXqNXSd6vVi3+iS89t3X8dcl53/2vP7Wmbvf79wrz69pvf/v0uP+v79q/53vfvet/7N/7rn3vV7v73/+/bvd9==


formula: Ca3 Si1.5 O7.5 H2
compound: <missing>
formula_title: <missing>
a: 3.6389
b: 16.311
c: 11.829
alpha: 90
beta: 90
gamma: 90
cell_volume: 702.100
crystal_density: 2.690
atoms_sites: ["Ca1", "Ca2", "Ca3", "Si1", "Si2", "O-H1", "O2", "O3", "O4", "O5", "O-H6", "O7", "O8"]
atoms_x: AAAAAICEHgCAhB4AwD4aAICEHgAAAAAAgIQeAICEHgCAhB4AAAAAAAAAAACANxYAAAAAAA==
atoms_y: QDUNAIBdGACg/QIAcEQFAHC/FgCw3RIAMK8HAFBNHABAFxIAoNgdAKBcCAAAGwgAwLYGAA==
atoms_z: AOgDAJAT/f8AhgsA0Mf5/2AGDQBAC/v/YDUBAEBsCACwogcAUCX5/xBpDgDgfPP/oD/4/w==
atoms_occupancy: AAk9AAAJPQAACT0AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQCAhB4AgIQeAA==
atoms_u_iso: ENYAACCyAABguAAA4KsAAAB9AADA2gAAIMsAAAB3AQDgKAEAQJwAACDLAADA2gAAwNoAAA==
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:
 Crystal structure of hillebrandite: A natural analogue of calcium silicate
 hydrate (CSH) phases in Portland cement

qdat:
AAAAAAAAAAAABAACACAAABAAACAQAEBQAAKKAiFGAAISgATAAECYYYaBQFCiSFIq3WClHNBkorQMCzpYGFUqBkTsvsUIdfBtE6HwBMcdRKdQiNBjJIAZWepoN7CVoTtKBYAtUyERNCAgGAoAs3UOMWLlAVloTZCRESAkkC==


formula: (Ti Mg2) O4
compound: <missing>
formula_title: <missing>
a: 8.44183
b: 8.44183
c: 8.44183
alpha: 90
beta: 90
gamma: 90
cell_volume: 601.603
crystal_density: 3.544
atoms_sites: ["Ti", "Mg", "Ti", "Mg", "O"]
atoms_x: IKEHACChBwCAhB4AgIQeAID3DwA=
atoms_y: IKEHACChBwCAhB4AgIQeAID3DwA=
atoms_z: IKEHACChBwCAhB4AgIQeAID3DwA=
atoms_occupancy: gDICAIDWOgBAax0AwJ0fAAAJPQA=
atoms_u_iso: 2GgAANhoAAAYUQAAGFEAAKh6AAA=
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:
 Study of the cubic to tetragonal transition in Mg2TiO4 and Zn2TiO4 spinels by
 17O MAS NMR and Rietveld refinement of X-ray diffraction data
 Sample: RLM445, 1405 C, Mg2TiO4

qdat:
AAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAQAAAAAQAAAAAAACAAAAgAAAAABAAAEAAAAAQAAIAAAAEAAIAAAAgACAAABAAIAAAQAEAAAIAEAAAgAgAAIAIAAEAEAAEAIAAAAgAAgCAAIAgACAQABAIAAgEAAAIABAQAAA==


formula: (Ti Mg2) O4
compound: <missing>
formula_title: <missing>
a: 8.46948
b: 8.46948
c: 8.46948
alpha: 90
beta: 90
gamma: 90
cell_volume: 607.533
crystal_density: 3.509
atoms_sites: ["Ti", "Mg", "Ti", "Mg", "O"]
atoms_x: IKEHACChBwCAhB4AgIQeAODnDwA=
atoms_y: IKEHACChBwCAhB4AgIQeAODnDwA=
atoms_z: IKEHACChBwCAhB4AgIQeAODnDwA=
atoms_occupancy: QB8AAMDpPADgdB4AIJQeAAAJPQA=
atoms_u_iso: kCkAAJApAABoPQAAaD0AAAi2AAA=
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:
 Study of the cubic to tetragonal transition in Mg2TiO4 and Zn2TiO4 spinels by
 17O MAS NMR and Rietveld refinement of X-ray diffraction data
 Sample: RLM509, 1210 C, Mg2TiO4

qdat:
AAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAgAAAAAgAAAAAAAEAAABAAAAAAEAAAIAAAAAgAAQAAAAQAAgAAACAAIAAAEAAgAABAAQAABAAQAACACAAAgAgAAQAgAAQAgAAACAAIAQABAEAAQBAAEBAAEBAAABAAICAAAI==


formula: Zn2 Ti O4
compound: <missing>
formula_title: Zn2TiO4
a: 8.47056
b: 8.47056
c: 8.47056
alpha: 90
beta: 90
gamma: 90
cell_volume: 607.766
crystal_density: 5.304
atoms_sites: ["Zn", "Ti", "Zn", "O"]
atoms_x: IKEHAICEHgCAhB4A8NwPAA==
atoms_y: IKEHAICEHgCAhB4A8NwPAA==
atoms_z: IKEHAICEHgCAhB4A8NwPAA==
atoms_occupancy: AAk9AICEHgCAhB4AAAk9AA==
atoms_u_iso: KEsAAPhcAAD4XAAAgI4AAA==
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:
 Study of the cubic to tetragonal transition in Mg2TiO4 and Zn2TiO4 spinels by
 17O MAS NMR and Rietveld refinement of X-ray diffraction data
 Sample: RLM526, 555 C, Zn2TiO4

qdat:
AAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAgAAAAAgAAAAAAAEAAABAAAAAAEAAAQAAAAAgAAQAAAAQAAgAAACAAIAAAEAAgAABAAQAABAAQAAEACAAAgBAAAQAgAAQBAAAAEAAIAQABAEAAQCAAIBAAEBAAABAAICAAAI==


formula: Zn2 Ti O4
compound: <missing>
formula_title: Zn2TiO4
a: 8.4608
b: 8.4608
c: 8.4608
alpha: 90
beta: 90
gamma: 90
cell_volume: 605.667
crystal_density: 5.322
atoms_sites: ["Zn", "Ti", "Zn", "O"]
atoms_x: IKEHAICEHgCAhB4AwOQPAA==
atoms_y: IKEHAICEHgCAhB4AwOQPAA==
atoms_z: IKEHAICEHgCAhB4AwOQPAA==
atoms_occupancy: AAk9AICEHgCAhB4AAAk9AA==
atoms_u_iso: qCUAAFg5AABYOQAA+AcAAA==
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:
 Study of the cubic to tetragonal transition in Mg2TiO4 and Zn2TiO4 spinels by
 17O MAS NMR and Rietveld refinement of X-ray diffraction data
 Sample: RLM510, 490 C, Zn2TiO4

qdat:
AAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAgAAAAAgAAAAAAAEAAAAgAAAAACAAAIAAAAAgAAQAAAAIAAQAAACAAIAAACAAgAAAgAIAAAgAQAACABAAAgAQAAIAQAAQAgAAACAAEAQAAgCAAIAgAEAgACAgAAAgAIBAAAC==


formula: Mg2 Ti O4
compound: <missing>
formula_title: <missing>
a: 5.97705
b: 5.97705
c: 8.4161
alpha: 90
beta: 90
gamma: 90
cell_volume: 300.666
crystal_density: 3.545
atoms_sites: ["Mg", "Ti1", "Mg1", "Ti2", "Mg2", "O1", "O2"]
atoms_x: YF4PAAAAAAAAAAAAgIQeAICEHgCAY/7/QKofAA==
atoms_y: YF4PAGBFDwBgRQ8A8JcOAPCXDgCA+CwAIO4PAA==
atoms_z: YOMWAAAAAAAAAAAAAAAAAAAAAADgag8AEDcOAA==
atoms_occupancy: AAk9AECEBADAhDgAwIQ4AECEBAAACT0AAAk9AA==
atoms_u_iso: WEMAAEg/AABIPwAAWEMAAFhDAABYOQAAaD0AAA==
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:
 Study of the cubic to tetragonal transition in Mg2TiO4 and Zn2TiO4 spinels by
 17O MAS NMR and Rietveld refinement of X-ray diffraction data
 Sample: RLM446, Mg2TiO4

qdat:
AAAAAAAAAAAAAAAAAEAAAEAABAACAAEAAAAgAQAQAQAgBAEAAFAQFAwKBAQADAgYOABhAAwUIMMIGAIMIMUYIAhCHMUoDjIcBjAVxlapARmuxEB1V+nQI/SCYGW/WyMmdI0B7u5jX+G0VJ9XGlWpC2oWTesRRf37Ez7pE5==


formula: Mg2 Ti O4
compound: <missing>
formula_title: <missing>
a: 6.00689
b: 6.00689
c: 8.41547
alpha: 90
beta: 90
gamma: 90
cell_volume: 303.653
crystal_density: 3.511
atoms_sites: ["Mg", "Ti1", "Mg1", "Ti2", "Mg2", "O1", "O2"]
atoms_x: kG8PAAAAAAAAAAAAgIQeAICEHgBAdv7/MFEfAA==
atoms_y: kG8PAJCODgCQjg4AYBMPAGATDwAQliwA4BkQAA==
atoms_z: YOMWAAAAAAAAAAAAAAAAAAAAAABAQg8AsBQOAA==
atoms_occupancy: AAk9AGBPBQCguTcAoLk3AGBPBQAACT0AAAk9AA==
atoms_u_iso: qCUAAFg5AABYOQAAWDkAAFg5AAD4BwAA+AcAAA==
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:
 Study of the cubic to tetragonal transition in Mg2TiO4 and Zn2TiO4 spinels by
 17O MAS NMR and Rietveld refinement of X-ray diffraction data
 Sample: RLM510, Mg2TiO4

qdat:
AAAAAAAAAAAAAAAAAEAAAEAACAACAAIAAAAAAgAgAwBACAIAAJBgKBgUEBAAEBBQqAEkAChJRUogiAg4QxFQQCEUpRGQNFDkGSCOojMiCMxUsgMiO5LBq+ESgm7TlDfn1aIVOtQw/xpE0fqyYlTJk3lorvMJ71tRKe+GEv==


formula: Fe2.558 Mg4.344 Al.012 Ca.086 Si8 O24
compound: <missing>
formula_title: <missing>
a: 9.5015
b: 18.1289
c: 5.3089
alpha: 90
beta: 102.090
gamma: 90
cell_volume: 894.184
crystal_density: 3.197
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:
 Crystal structure of P2_1/m ferromagnesian amphibole and the role of cation
 ordering and composition in the P2_1/m - C2/m transition in cummingtonite
 Sample: UH1, untreated

atoms_sites:
["Fe1", "Mg1", "Fe2", "Mg2", "Al2", "Fe3", "Mg3", "Fe4", "Mg4", "Ca4", "Si1", "Si2", "O1", "O2", "O3", "O4", "O5", "O6", "O7"]

atoms_x:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHCSEQCwLhIAYPgGAACFBwBQ6gYAUDkXAKByFQAwWxUAoPUUAA==

atoms_y:
0E0FANBNBQAwzwoAMM8KADDPCgAAAAAAAAAAAFDNDwBQzQ8AUM0PAKAjBQCATQoA0E0FABCBCgAAAAAAYPoOAJADCACQOwcAAAAAAA==

atoms_z:
gIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AgIQeABDBEABAri8AwMQMABDnKwDAIysAEO4uAGDxAwAgGCIAMHkQAA==

atoms_occupancy:
ADUMAADUMADgjQUAYB03AMBdAACAAgoAgAYzAEBMNwDgHAMA4J8CAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
0IQAANCEAAAwiQAAMIkAADCJAAAgZwAAIGcAADi4AAA4uAAAOLgAABhvAAAgcQAAsIYAANCOAABYpwAAaLUAAADNAAD46AAA+MoAAA==

qdat:
AAAAAAAAAAAECAAAAAAASAEQAKAAAAGgIIKQAAwAcIgQEQUKgAWGCQIQDjQhM6gI3A2OTLsECIEu2zkQD1amgPkTSjR0kwvImYUW5ucshOTzHwsuHoxr8pjczjIX8rCfyXMB+0ftAVaTXW45S8TFmaNGzUGCA1OFNZNmQ7==


formula: Fe2.622 Mg4.254 Al.014 Ca.11 Si8 O24
compound: <missing>
formula_title: <missing>
a: 9.5048
b: 18.1343
c: 5.3077
alpha: 90
beta: 102.009
gamma: 90
cell_volume: 894.829
crystal_density: 3.204
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:
 Crystal structure of P2_1/m ferromagnesian amphibole and the role of cation
 ordering and composition in the P2_1/m - C2/m transition in cummingtonite
 Sample: 11a, heat treated at 600 C

atoms_sites:
["Fe1", "Mg1", "Fe2", "Mg2", "Al2", "Fe3", "Mg3", "Fe4", "Mg4", "Ca4", "Si1a", "Si2a", "Si1b", "Si2b", "O1a", "O2a", "O3a", "O4a", "O5a", "O6a", "O7a", "O1b", "O2b", "O3b", "O4b", "O5b", "O6b", "O7b"]

atoms_x:
UL/w/1C/8P8wvPD/MLzw/zC88P9wwvD/cMLw/yCu8P8grvD/IK7w/3BWAgCw2QIA4MwgAHB9IQDwvff/IDP4/zDE9//A4gcAEBwGAFA7BgCQxAUAEDkWAODWFgCwFhYAQJkmAJC5JAAwfiQA8CwkAA==

atoms_y:
EJAUABCQFACQFBoAkBQaAJAUGgBAQg8AQEIPAJAPHwCQDx8AkA8fAHBnFAAgmRkAsOUyAOAKOACAjhQAcMYZAEBCDwCAUh4AwOwWAMDsFgBAQg8AIBYzAFBUOADAxi0AIKg8AHD/NQDAtTQAwMYtAA==

atoms_z:
kBUeAJAVHgCwkDwAsJA8ALCQPABAqzwAQKs8APDsHQDw7B0A8OwdAMAvEABgGy8A4CwRAEASMACAWgwAkEQrAODCKgDAVi8A0JECADDIIACwZhEAkDANAOBSLADwmCsAkJYuAKDYBABA/CIA0PIPAA==

atoms_occupancy:
QL8PAMBJLQAgEgoAgIkyAGBtAACAbQ0AgJsvAEB8LwBgMQoAYFsDAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
4IgAAOCIAAA4gQAAOIEAADiBAAAwcAAAMHAAADi4AAA4uAAAOLgAALhlAAC4agAAwGcAAJhsAADwcwAAQJIAAAiTAACotgAAINAAAADwAAAg5AAAGIgAAHCFAAAQqQAAcLcAABi1AABYwAAAaKYAAA==

qdat:
AAAAAAAAAAAMCAAAQAAASgEYAqCCEAGgITqSGEwAdohRs8cMqDWOO8IxbXhhN6wrvB2vXrslXUq92znzH3fKuP5f7lb69i3Ls7Vf/9ptvc733147L+53/5/vz24f893bX+9D/r/Kmv+lfe/X/1zXm+df76smJ/ndeu3t0/==


formula: Fe2.473 Mg4.423 Al.014 Ca.1 Si8 O24
compound: <missing>
formula_title: <missing>
a: 9.5057
b: 18.1187
c: 5.3059
alpha: 90
beta: 102.031
gamma: 90
cell_volume: 893.768
crystal_density: 3.191
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:
 Crystal structure of P2_1/m ferromagnesian amphibole and the role of cation
 ordering and composition in the P2_1/m - C2/m transition in cummingtonite
 Sample: 1c, heat treated at 700 C

atoms_sites:
["Fe1", "Mg1", "Fe2", "Mg2", "Al2", "Fe3", "Mg3", "Fe4", "Mg4", "Ca4", "Si1a", "Si2a", "Si1b", "Si2b", "O1a", "O2a", "O3a", "O4a", "O5a", "O6a", "O7a", "O1b", "O2b", "O3b", "O4b", "O5b", "O6b", "O7b"]

atoms_x:
sMjw/7DI8P8wvPD/MLzw/zC88P+QxfD/kMXw/zCj8P8wo/D/MKPw/yBbAgBQ0AIAgMMgALCDIQBgvPf/0Df4/+Cv9//Q1wcAsCsGAMBSBgDwzQUAgDcWAMDTFgAgLhYAYJwmAEClJABQaCQA4B4kAA==

atoms_y:
EJAUABCQFACQFBoAkBQaAJAUGgBAQg8AQEIPAJAPHwCQDx8AkA8fAABpFAAgmRkAsOUyAHAMOACAjhQAQM4ZAEBCDwDAWB4A8OQWAMDsFgBAQg8AsBczAFBUOADAxi0AkKY8ACAENgAQsTQAwMYtAA==

atoms_z:
MAweADAMHgCggjwAoII8AKCCPABQoDwAUKA8AJDjHQCQ4x0AkOMdABArEADgDi8AIDMRAIAYMAAQXAwAsC4rAJDHKgDgci8AsHUCAAC3IACQfBEAsDMNALBaLACAsysAQIIuAJDjBAAADyMAkNMPAA==

atoms_occupancy:
QEIPAMDGLQDg8gkAwKgyAGBtAAAgfQ0AICgwAKCEKwAgdw4AQA0DAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
IIUAACCFAACYgAAAmIAAAJiAAACoawAAqGsAAEC1AABAtQAAQLUAAJB5AADAcQAAwGIAANB1AADQkwAAsIEAAPiYAADwvgAAgNQAANDeAAB4rwAA8H0AAACbAADAwQAA0KwAAAi2AABA2AAA8OYAAA==

qdat:
AAAAAAAAAAAMCAAAQAAASgEYAqCCEAGgITaaGEwAdohR86cKqDWGK8IRb/hhN6wr3B2vXpskvMuv2znrC3fvtP5fbjb/9ivLurXf/95tusb3/18/P+53f5//zy8f8d3fX38j/2/Lnd/ldO/f/tbL2edv76mzFv3/N3fm8b==


formula: Si2 Mg1.15 Fe.807 Ca.043 O6
compound: <missing>
formula_title: <missing>
a: 18.316
b: 8.907
c: 5.218
alpha: 90
beta: 90
gamma: 90
cell_volume: 851.268
crystal_density: 3.541
atoms_sites: ["Sia", "Sib", "Mg1", "Fe1", "Fe2", "Mg2", "Ca2", "O1a", "O1b", "O2a", "O2b", "O3a", "O3b"]
atoms_x: CJIQALjuHACg6RYAoOkWAMgRFwDIERcAyBEXAPgzCwCQVyIACP4SAJB9GgDocxIAeE4bAA==
atoms_y: 4MkUAGCLFAD48ycA+PMnACB8HQAgfB0AIHwdAHiWFAAAhxQAyIweALiiHQCAJg4AwGAMAA==
atoms_z: YCkDAFiLMABQXDUAUFw1ABB1FgAQdRYAEHUWAGipAgAAjjAAIEEDAIiYKgBwO/X/YDokAA==
atoms_occupancy: AAk9AAAJPQAAsDYAAFkGAGDoKgDAgA8A4J8CAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: 0
atoms_aniso_label: ["Sia", "Sib", "Mg1", "Fe1", "Fe2", "Mg2", "Ca2", "O1a", "O1b", "O2a", "O2b", "O3a", "O3b"]
atoms_aniso_u11: 4HQAANh8AADAlAAAwJQAALCkAACwpAAAsKQAADB6AACQbwAASLcAAPC5AABgnwAAsKQAAA==
atoms_aniso_u22: 2FQAALhgAAAYbwAAGG8AAOiZAADomQAA6JkAACiWAAAooAAAoHgAAGicAABoqwAAyK8AAA==
atoms_aniso_u33: cD8AADAvAAC4OAAAuDgAAMg3AADINwAAyDcAAGBFAABwTgAAeGQAACBiAADgiAAA2IsAAA==
atoms_aniso_u12: SO///yASAAAAAAAAAAAAAIjw//+I8P//iPD//wjz//84DgAAOOb//0ApAABAAQAAGPz//w==
atoms_aniso_u13: OP///+AGAACY9P//mPT//8Db///A2///wNv//wAZAADQ5P//GNT//6Dx//8wGwAAYPX//w==
atoms_aniso_u23: CP3//1AAAAB4BQAAeAUAAAj9//8I/f//CP3///AFAABoCwAAaAEAAPgbAAAIqP//6Kn//w==
pub_title:
 Orthopyroxene from the Serra de Mage meteorite: Structure refinement and
 estimation of C2/c pyroxene contributions to apparent Pbca diffraction
 violations
 Sample: OPX SDM N.13, natural

qdat:
AAAAAAAAAAAEAAAAIAAAAABEgDQABABEDgIIJgEAUmwKgSdzIeCdJSyQ2zaBjbpWX+7S+J/lkf2IvaOxu+yn/duZZ+XKb26NZrXa47++Xq/379Xvx61d71WL33/zb//ebvu3d71723uXmdtfa7/Df3ZcrNmmTcpnP9723d==


formula: Si2 Fe.802 Mg1.155 Ca.043 O6
compound: <missing>
formula_title: <missing>
a: 18.320
b: 8.917
c: 5.219
alpha: 90
beta: 90
gamma: 90
cell_volume: 852.573
crystal_density: 3.533
atoms_sites: ["Sia", "Sib", "Fe1", "Mg1", "Fe2", "Mg2", "Ca2", "O1a", "O1b", "O2a", "O2b", "O3a", "O3b"]
atoms_x: kJYQAJjrHABw7BYAcOwWAIAOFwCADhcAgA4XADA9CwC4UiIAEPsSAGh9GgAwchIA+FAbAA==
atoms_y: YMcUAECIFACw6ycAsOsnANh9HQDYfR0A2H0dAFidFAA4mhQAwIAeAKCNHQB4EA4AqFUMAA==
atoms_z: uBcDACiJMACYQTUAmEE1AGhjFgBoYxYAaGMWANBGAgD4WTAA4PQCAECVKgDwefX/wGskAA==
atoms_occupancy: AAk9AAAJPQAAKQ4AAOAuAEDKIgDgnhcA4J8CAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: 0
atoms_aniso_label: ["Sia", "Sib", "Fe1", "Mg1", "Fe2", "Mg2", "Ca2", "O1a", "O1b", "O2a", "O2b", "O3a", "O3b"]
atoms_aniso_u11: +FwAAOB0AADgdAAA4HQAAGiXAABolwAAaJcAAFhSAADINwAA8GQAAHCPAABgnwAA+LEAAA==
atoms_aniso_u22: +D4AACBTAABAWwAAQFsAAKCqAACgqgAAoKoAAHB7AABAsAAA2KQAALDWAADAvAAA2KQAAA==
atoms_aniso_u33: WHUAAAhhAADAXQAAwF0AALBeAACwXgAAsF4AAFhmAADgYAAA4I0AAECDAACghwAA8H0AAA==
atoms_aniso_u12: EOb//zAbAAAY/P//GPz//wjz//8I8///CPP//7D1//84DgAAcNH///AZAADwzv//aAYAAA==
atoms_aniso_u13: YPX//0AVAAAYBgAAGAYAAADn//8A5///AOf//yD5//8g+f//8N3//3D+//+oLwAAcP7//w==
atoms_aniso_u23: MAIAAFgHAAD4AgAA+AIAAND9///Q/f//0P3//yAhAAAwJQAAiBMAAFgHAABAwP//YJv//w==
pub_title:
 Orthopyroxene from the Serra de Mage meteorite: Structure refinement and
 estimation of C2/c pyroxene contributions to apparent Pbca diffraction
 violations
 Sample: OPX SDM N.7, heated

qdat:
AAAAAAAAAAAEAAAAIAAAAABEgDQABABIDgIIJgEAUmwKgSdzIeGpZTiQ2zcBlfp2b3bS8J/Jkf6IvyKyu9zv9Z6b5udK766P6qVz5a9+W1/3T217xb79718b+//X777er9739/6v63Ovsv/Wt9eH3XpdrbFu39ztP9b7ed==


formula: Pb2.198 (Si2.4 Al1.6) O8
compound: <missing>
formula_title: Pb(Al,Si)4O8
a: 9.414
b: 9.414
c: 2.75
alpha: 90
beta: 90
gamma: 90
cell_volume: 243.714
crystal_density: 9.457
atoms_sites: ["Pb1", "Pb2", "Si", "Al", "O1", "O2"]
atoms_x: sKcCAAAAAABgbBUAYGwVAKBvCQCgESEA
atoms_y: AAAAAAAAAABg/wkAYP8JAABODAAQBAoA
atoms_z: IE4ZADDRKwAAAAAAAAAAAAAAAAAAAAAA
atoms_occupancy: QHEcAMBiFAAAnyQAAGoYAAAJPQAACT0A
atoms_u_iso: 4CgBAOAoAQDIeAAAyHgAADhPAAA4TwAA
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:
 Crystal chemistry of lead aluminosilicate hollandite: A new high-pressure
 synthetic phase with octahedral Si

qdat:
AAAAAAAAAAAAAAACAAAAAAQAAAAAAAAEAAAQAAACAAAAEEAQACCAAAAICAACAAAgBACIAAIgAAAAQDCIRAEBiACAQkAiAAJiAEBEiQICAEAQAMSKAIlAgwQxAYYQQJZgAhwACBDAGEIQgkkEAQAREAIAoVEiIIKFJCFAFF==


formula: Sb2 As S2
compound: <missing>
pub_title: Crystal structure and twinning of Sb2AsS2, the synthetic analogue of paakkonenite
formula_title: <missing>
a: 10.75
b: 3.959
c: 12.49
alpha: 90
beta: 115.25
gamma: 90
cell_volume: 480.777
crystal_density: 5.285
atoms_sites: ["Sb1", "Sb2", "As", "S1", "S2"]
atoms_x: wD39/3AJEwDgivn/IOcMABC4BQA=
atoms_y: AAAAAICEHgCAhB4AAAAAAICEHgA=
atoms_z: MLYKADBJGADA8wAAgIAOAEDtGAA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Sb1", "Sb2", "As", "S1", "S2"]
atoms_aniso_u11: oAMCAOClAQCghgEAwNQBAGDkAQA=
atoms_aniso_u22: YOoAAOClAQBg6gAAgDgBAIA4AQA=
atoms_aniso_u33: wNQBAECKAwDgqwAAIE4AAKB6AwA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: oAkBAMBXAQAgTgAAQJwAACDFAQA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
qdat:
AAAAAAAAAIAAAAAAAAEAAEAAAABBEAAIABAAEgAAABAgACIBAAYgBCACgYRJoABAbAEHQoIJBAY8DAARsSAegD4yigUouQbFYAHguagDDByOo8Bh0G9EtaDGlVwBwPJAr4jBG6XE34EwTKnSOHLMUTJgzIvFD0qxau5okJ==


formula: Y2 Na15 Cl C9 O30 S F
compound: <missing>
pub_title: Reederite -(Y), a new sodium rare-earth mineral with a unique fluorosulfate anion
formula_title: <missing>
a: 8.773
b: 8.773
c: 10.746
alpha: 90
beta: 90
gamma: 120
cell_volume: 716.265
crystal_density: 2.776
atoms_x: AAAAAFVYFADQgxUAEHUlACAQGwAAAAAAVVgUAECUKwCwjBMAkHk3APDSMgDQOjYA0MM0AMDOAgDgzQsAVVgUAFVYFAA=
atoms_y: AAAAAKuwKACAIDcAkMs6ABBhBwAAAAAAq7AoAHByJwAQYw8AcBYVABB4MQCAXyAAUCYvABCpLQAgFx4Aq7AoAKuwKAA=
atoms_z: 0N4KAHAaDADw9Q8AAAAAAICEHgCAhB4AAAAAAAAAAADQtCoAkMo2AAAAAABw7ycAQEIoAFA5MACAhB4AgIQeAFCQFQA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AICEHgA=
atoms_u_iso: QJwAAEAZAQDAVwEAwM4CAMBXAQAAdwEAwHoQACDLAAAgywAAAPQBAMBXAQDgKAEAAPoAAEAZAQCg6wUAQBkBAGDqAAA=
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
atoms_sites:
["Y", "Na1", "Na2", "Na3", "Na4", "Na5", "Cl", "C1", "C2", "O1", "O2", "O3", "O4", "O5", "O6", "S", "F"]

qdat:
AAAAAAAAACAAABAABAAEAAABABAEAQBAIBAAEDAgQIEAACCBCCCEAIIQgCEAxCIRCARERiACJEREBIkRIESJIgiCZAJIkkEkkkFJJISUkBJSkJKUhSlIUpQJUqFSpDqlFCoFUqKpkVVRRMFzMVVRXaKshViKVRq0YqFqxY==


formula: Pb2 Fe11 O18.19
compound: <missing>
pub_title: Plumboferrite: New mineralogical data and atomic arrangement
formula_title: <missing>
a: 5.9356
b: 5.9356
c: 23.576
alpha: 90
beta: 90
gamma: 120
cell_volume: 719.333
crystal_density: 6.093
atoms_sites: ["Pb1", "Pb2", "Fe1", "Fe2", "Fe3", "Fe4", "O1", "O2", "O3", "O4", "O5"]
atoms_x: MJ8rAECLAgAAAAAAVVgUAFVYFABoUQoAAAAAAFVYFABwawsA4I4JAPC0HgA=
atoms_y: 0GDU/4AWBQAAAAAAq7AoAKuwKADQohQAAAAAAKuwKABw2BYAUB8TABBL4f8=
atoms_z: GJwPAKhrDwAAAAAAeJoBAKBFCwCQhfn/cOEIABC8/P9AQg8AsCQDAKALCQA=
atoms_occupancy: OCwKADgsCgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQBAjiwAAAk9AAAJPQA=
atoms_u_iso: AH0AAGBUAACgQQAA0DkAAPDSAAAQQAAAcEkAANA5AAAQmAIAkEwAAJBMAAA=
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:
AAAAAAAABAAAAAAAABAAJAQAIACgAAQAAEAMIQAEBiBAVAEADAgQABiECQIAYZUCEgCQEBGQBkiGBAQhAGkKEDAQBpFEDOoigoIJAFqIQJUJSUQyQNRkGCBAQBclyRRelQwiQLRIQQIEBYPSIkh1kIQQQFlIRBBayKy8mV==


formula: Si6 Na1.8 Ca1.11 O14
compound: <missing>
formula_title: Na1.8Ca1.1Si6O14
a: 7.903
b: 7.903
c: 4.595
alpha: 90
beta: 90
gamma: 120
cell_volume: 248.542
crystal_density: 3.196
atoms_sites: ["Si1", "Si2", "Si3", "Na", "Ca", "O1", "O2", "O3"]
atoms_x: q7AoANifLQAAAAAACFIZAAhSGQBQ2ioAq7AoALC0NgA=
atoms_y: VVgUANifLQAAAAAACFIZAAhSGQAg7CAAVVgUADA2MAA=
atoms_z: sOYdAICEHgAAAAAAAAAAAAAAAACQZBUAAJYyAEDmLgA=
atoms_occupancy: AAk9AAAJPQAACT0AAJ8kAECVFgAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Si1", "Si2", "Si3", "Na", "Ca", "O1", "O2", "O3"]
atoms_aniso_u11: 8FUAACBOAABgVAAAMKcAADCnAAAgFgEA4EEBABByAAA=
atoms_aniso_u22: 8FUAACBOAABgVAAAMKcAADCnAACwaAAA4EEBANBrAAA=
atoms_aniso_u33: gFcAAIA+AACQMwAAUJEAAFCRAACQfgAAMFwAANBSAAA=
atoms_aniso_u12: +CoAABAnAAAwKgAAgD4AAIA+AACQZQAA8KAAAPA8AAA=
atoms_aniso_u13: AAAAAFD7//8AAAAA0AcAANAHAADQ1f//AAAAADDf//8=
atoms_aniso_u23: AAAAALAEAAAAAAAAMPj//zD4///Q7v//AAAAANDu//8=
pub_title:
 Stability and structure of a new high-pressure silicate, Na1.8Ca1.1Si6O14
 Sample: data collected on a diffractometer
 Note: U(2,3) for Si2, Na/Ca altered to match symmetry constraints.

qdat:
AAAAAAAAAAAAAAAIAAAAAABAAAEEAACAAAAgAAQAEAAAAFEAgAAQCgBQACACAwAACICAIA0EAKAgMAAFBgKCQQEBQgATFQClSBQCIAnCBFkQIVYACgksIlgsBmpEWKSogLKAmJUMiTItSguUIgqdCZKB7jGqrETvL73GGc==


formula: Si6 Na1.8 Ca1.11 O14
compound: <missing>
formula_title: Na1.8Ca1.1Si6O14
a: 7.903
b: 7.903
c: 4.595
alpha: 90
beta: 90
gamma: 120
cell_volume: 248.542
crystal_density: 3.196
atoms_sites: ["Si1", "Si2", "Si3", "Na", "Ca", "O1", "O2", "O3"]
atoms_x: q7AoAJChLQAAAAAAmFMZAJhTGQCg1SoAq7AoAJCxNgA=
atoms_y: VVgUAJChLQAAAAAAmFMZAJhTGQCQ6iAAVVgUADA2MAA=
atoms_z: 0OkdAICEHgAAAAAAAAAAAAAAAAAAYxUA8KAyAHDeLgA=
atoms_occupancy: AAk9AAAJPQAACT0AAJ8kAECVFgAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Si1", "Si2", "Si3", "Na", "Ca", "O1", "O2", "O3"]
atoms_aniso_u11: 8DwAAHAwAAAgNQAAsIEAALCBAABAAAEAIC8BANBSAAA=
atoms_aniso_u22: 8DwAAHAwAAAgNQAAsIEAALCBAACQTAAAIC8BAJBMAAA=
atoms_aniso_u33: AEsAAAAyAAAwKgAAgIkAAICJAABQeAAA0FIAAHBJAAA=
atoms_aniso_u12: eB4AAFAUAACQGgAAwCsAAMArAABgVAAAkJcAAPAjAAA=
atoms_aniso_u13: AAAAAOD8//8AAAAA0AcAANAHAADgyv//AAAAAHDl//8=
atoms_aniso_u23: AAAAACADAAAAAAAAMPj//zD4//8Q9f//AAAAANDu//8=
pub_title:
 Stability and structure of a new high-pressure silicate, Na1.8Ca1.1Si6O14
 Sample: data collected on an image plate
 Note: U(2,3) for Si2, Na/Ca altered to match symmetry constraints.

qdat:
AAAAAAAAAAAAAAAIAAAAAABAAAEEAACAAAAgAAQAEAAAAFEAgAAQCgBQACACAwAACICAIA0EAKAgMAAFBgKCQQEBQgATFQClSBQCIAnCBFkQIVYACgksIlgsBmpEWKSogLKAmJUMiTItSguUIgqdCZKB7jGqrETvL73GGc==


formula: Ca Al2 Si2 O10 H4
compound: <missing>
pub_title: Low-temperature phase transitions and the role of hydrogen bonds in lawsonite Sample: T = 110 K
formula_title: <missing>
a: 5.855
b: 8.762
c: 13.094
alpha: 90
beta: 90
gamma: 90
cell_volume: 671.742
crystal_density: 3.107
atoms_occupancy: 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
atoms_sites:
["Ca", "Al", "Ala", "Si", "Sia", "O1", "O2", "O2a", "O2b", "O2c", "O3", "O3a", "O4a", "O4", "O5", "Hw", "Hwa", "Hh", "Hha"]

atoms_x:
IGcAAEBCDwCgAA8AkM///2Dw//9Aif//AMwQALBTEADQKywA8C4sAIAlAADQ7v//EPX//yCf///gNP//gMH//8B4OgAAfQAA4J8CAA==

atoms_y:
wD8UAMA6DwCwYw8A+NA7AHiwOwCwCwMAsMUWAKBNFwAwDiYAEFYmANBZCAB4OQgAAJMmADAIJwDgMSUAABAnAKANKgDg5SAAACgjAA==

atoms_z:
0FIPAGD6///4mB4AiAsIADBQFgA4MQ8AgEYHAMCMFwC41TUAgPAlAOjXAwCggRoAWA4cAPgYAwC4JA8AYCsLAOBFEQAgQgIAwEQZAA==

atoms_u_iso:
kD0AAPglAAAIIAAAOCcAAKAoAAA4RQAAqEgAAKhIAACoSAAAqEgAAFg5AABIPwAAaD0AAChLAACgggAAECoCANCgAgCw7gEAmCwEAA==

qdat:
AAAAAAAAAAAAAAIAgAAAAEAhAABABBBAwBABDCMQhiAyCJCBgNGqEWAkuMCLphNGtgFGpD0nsvYXKiuZ+X5HsM9m5PVrPcnS+rXbTO/YdS5/+67f3a/369U/1/Pfb13+n/29mz7+7jX/TZs++/69Vef33Pd1RfqI739X/3==


formula: Ca Al2 Si2 O10 H4
compound: <missing>
pub_title: Low-temperature phase transitions and the role of hydrogen bonds in lawsonite Sample: T = 155 K
formula_title: <missing>
a: 5.853
b: 8.766
c: 13.100
alpha: 90
beta: 90
gamma: 90
cell_volume: 672.127
crystal_density: 3.105
atoms_x: AAAAAEBCDwBAQg8AAAAAAAAAAAAAAAAAQNIQAKiSEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_y: OEUUAEBCDwBAQg8AMNU7AAi3OwDgDQMAGMcWADguFwBQYQgAMEUIACATJwCAnyYA8CYlAEAvJwDAYSkAIAUhAODZIgA=
atoms_z: kFEPAAAAAACAhB4AAAwIAPhQFgA4MQ8A4FQHADByFwBo2gMAiIAaAIAdAwA4BhwAECcPAOBpCwBghBEA4CICAGBUGQA=
atoms_occupancy: 0
atoms_u_iso: 8FAAADgnAACwLAAA8C0AANAvAABYUgAASFgAANBDAABYQwAAUEEAADhFAAAoVQAAGLAAAPB3AQCotAIAWMgCAAB9BQA=
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
atoms_sites:
["Ca", "Al", "Ala", "Si", "Sia", "O1", "O2", "O2a", "O3", "O3a", "O4", "O4a", "O5", "Hw", "Hwa", "Hh", "Hha"]

qdat:
AAAAAAAAAAAAAAIAgAACAAAhAABACBBAwAABCAMRBCAxCJCBgBIKEGIkscBLoBFOtgFmpAwnpuYnE3OB+T5FoJ8kxPHrD8oXznnKTP2YYWR7ep6Xzen3i9St03G2L2/Wj/mckzy85zR7TRtXu87ZVeDXnJdJRbqI23Vr1T==


formula: Ca Al2 Si2 O10 H4
compound: <missing>
pub_title: Low-temperature phase transitions and the role of hydrogen bonds in lawsonite Sample: T = 233 K
formula_title: <missing>
a: 5.852
b: 8.777
c: 13.113
alpha: 90
beta: 90
gamma: 90
cell_volume: 673.523
crystal_density: 3.099
atoms_x: AAAAAEBCDwBAQg8AAAAAAAAAAAAAAAAAUMcQAMCTEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_y: UEsUAEBCDwBAQg8AKNg7ABjAOwAgCgMAsN4WAMAyFwBwZAgAAE0IAGAZJwCguyYAEColAGB9JwAgUikA4N8hAODZIgA=
atoms_z: +E0PAAAAAACAhB4AgA4IAAhVFgCYNQ8A8EkHACBzFwCY4QMAYIAaAGAaAwCI7RsAmCsPAOBpCwBghBEAwFECAGDRGQA=
atoms_occupancy: 0
atoms_u_iso: YG0AAEg1AADwNwAAaDgAADg7AADwZAAA+GYAABBZAAAwTQAAIFMAAAhXAADQcAAAeOsAANCgAgD4jAIA2JAFAIh/BwA=
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
atoms_sites:
["Ca", "Al", "Ala", "Si", "Sia", "O1", "O2", "O2a", "O3", "O3a", "O4", "O4a", "O5", "Hw", "Hwa", "Hh", "Hha"]

qdat:
AAAAAAAAAAAAAAIAgAACAAAhAABACBBAwAABCAURBCAyCJCDgBISEGIkscDLwBFPOgOuzAgnp8wvE3MB6T7OoJ5FSfHzHsoXynnane+wYkT/ex6e2Unbkukq96K8e2V+l9k8kn3oxSxz3Rqb886zFeFmnTeKRzqQ/7V+9X==


formula: Ca Al2 Si2 O10 H4
compound: <missing>
pub_title: Low-temperature phase transitions and the role of hydrogen bonds in lawsonite Sample: T = 295 K
formula_title: <missing>
a: 5.847
b: 8.790
c: 13.128
alpha: 90
beta: 90
gamma: 90
cell_volume: 674.715
crystal_density: 3.093
atoms_sites: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5", "Hw", "Hh"]
atoms_x: AAAAAEBCDwAAAAAAAAAAANijEAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
atoms_y: aFYUAEBCDwA41zsAAAcDAGAfFwCwZQgA0AMnAFAwJQCASCgAYB4iAA==
atoms_z: QEIPAAAAAAAgHggAQEIPAAgjBwAo9wMA6OwCAEBCDwBgJQwAwEsDAA==
atoms_occupancy: 0
atoms_u_iso: WIkAAIBDAADoRAAAuH4AAFBzAAD4XAAAqH8AAMA0AQC4AwMAAH0FAA==
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:
AAAAAAAAAAAAAAAAgAAAAEAhAQBACAABQBABAAERhAAiAJEDoQIQEMAiEICDyCaDcgGOzAkGhdAvEwMT6HyOQK5MCcPjBdRrmnVeEd+o6AXXDpec25GPRvie83eMa7+4f56ecrV5oDhzjxkf+8T7DTP3HjYCVwmA/z4Mq5==


formula: Ca Al2 Si2 O10 H4
compound: <missing>
pub_title: Low-temperature phase transitions and the role of hydrogen bonds in lawsonite Sample: T = 410 K
formula_title: <missing>
a: 5.851
b: 8.799
c: 13.136
alpha: 90
beta: 90
gamma: 90
cell_volume: 676.280
crystal_density: 3.086
atoms_sites: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5", "Hw", "Hh"]
atoms_x: AAAAAEBCDwAAAAAAAAAAAJClEAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
atoms_y: VVgUAEBCDwCI1zsAwAADAPgiFwB4ZggAgAgnAJA2JQAgWCgA4FwiAA==
atoms_z: QEIPAAAAAACoHQgAQEIPAHghBwDo+gMAiO0CAEBCDwBgJQwAAGsDAA==
atoms_occupancy: 0
atoms_u_iso: aKsAAHBTAADIUAAAeJYAAFCHAAAYbwAAOJAAAPh5AQBoKwMAGBoFAA==
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:
AAAAAAAAAAAAAAAAgAAAAEBBAQBACAABQBABAAERiAAiAJEDoQQQEMAkIICHyC6FcgMNSBEHhZBPJgYXcHUeQa6cE8OiBZh1PGbcIX8xcA1+Cx8Z9yGOivG91W8Y/vdQdx8c1DbzQHDnFTsfs8j2GmPuLFwGZhKA/nQZ1z==


formula: Ca Al2 Si2 O10 H4
compound: <missing>
pub_title: Low-temperature phase transitions and the role of hydrogen bonds in lawsonite Sample: T = 500 K
formula_title: <missing>
a: 5.857
b: 8.810
c: 13.150
alpha: 90
beta: 90
gamma: 90
cell_volume: 678.542
crystal_density: 3.076
atoms_sites: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5", "Hw", "Hh"]
atoms_x: AAAAAEBCDwAAAAAAAAAAABCoEAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
atoms_y: yFUUAEBCDwBo1DsA0PUCAJAmFwBwZAgAeAsnAPA/JQDgOCgAIHwiAA==
atoms_z: QEIPAAAAAAAwHQgAQEIPALAgBwAoAQQACOsCAEBCDwDAFQwAIL8CAA==
atoms_occupancy: 0
atoms_u_iso: qOgAAFhwAADoZwAA8MMAACiqAAAYkgAAILIAAMDoAQBYyAIAwPMFAA==
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:
AAAAAAAAAAAAAAAAgAAAAEBBAgCACAABQCABAAITCAAiARMFQQQgIcAkIQEHiC0G1AMNmBIPBxBfJgYn0PkcQV6YI4fCB6jXeOu4I9ph4Av+GT473iMdFeF7q64x7/2g3z45qm1mgNHkLPY7a5HsFMdUWLgNzCoB+rQ6nq==


formula: Sr Mn2 Si2 O10 H8
compound: <missing>
pub_title: Lawsonite-type phase transitions in hennomartinite, SrMn2[Si2O7](OH)2.H2O T = 22 C
formula_title: <missing>
a: 6.247
b: 9.034
c: 13.401
alpha: 90
beta: 90
gamma: 90
cell_volume: 756.291
crystal_density: 3.704
atoms_occupancy: 0
atoms_aniso_label: ["Sr", "Mn", "Mn1", "Si", "Si1", "O1", "O2", "O21", "O22", "O23", "O3", "O31", "O4", "O41", "O5"]
atoms_aniso_u11: AH0AAIBXAACAVwAAcGIAAHBiAACAuwAAgIkAAICJAACAiQAAgIkAAKCMAACgjAAAAH0AAAB9AAAgQgIA
atoms_aniso_u22: QJwAAOBHAADgRwAAwEQAAMBEAABwlAAAEHIAABByAAAQcgAAEHIAAJBlAACQZQAA4HkAAOB5AAAgSAEA
atoms_aniso_u33: UHgAAHBJAABwSQAAsE8AALBPAAAgTgAAkGUAAJBlAACQZQAAkGUAANCEAADQhAAAkH4AAJB+AADgKAEA
atoms_aniso_u12: 8PH//7AEAACwBAAAAAAAAAAAAABg8P//AOf//wDn//8A5///AOf//5ABAACQAQAAEPX//xD1//9Aov//
atoms_aniso_u13: UC0AADDf//8w3///YPD//2Dw///gsf//wOD//8Dg///A4P//wOD//6APAACgDwAAoA8AAKAPAAAg1/7/
atoms_aniso_u23: sAQAAAAZAAAAGQAAoA8AAKAPAABg8P//wOD//8Dg///A4P//wOD//2Dw//9g8P//YPD//2Dw//8AAAAA
atoms_sites:
["Sr", "Mn", "Mn1", "Si", "Si1", "O1", "O2", "O21", "O22", "O23", "O3", "O31", "O4", "O41", "O5", "HwL", "HwR", "Hw1L", "Hw1R", "HhL", "HhR", "Hh1L", "Hh1R"]

atoms_x:
GAoBAGD6DgAgJg8AYPD//4DB//9Q6P7/QDYRAAAXEQCge+7/QA7u/6APAADgqwAAYPD//2D2/v9gef7/gPf2/4D39v+Ax/7/gMf+/8CB+v/Agfr/wNQBAMDUAQA=

atoms_y:
+AMTAGCpDwDATg8AsEs7AGAFOwCgOwEAgLQWAOAhFwCgTun/YBDq/wDQBwBgwAcAAN4mAFBDJgAgHyUAQDUmAEA1JgBALycAQC8nAEA7JQBAOyUAYKEhAGChIQA=

atoms_z:
0FwPAFCw//9wqB4AsAYIALBhFgBQHg8AoOUGADDlFwBQ2vj/gBnp/6CNBACwzBkA4NECAPBDHAAwGw8AgN4PAACmDgDg5gsAoJ0SAGBUGQAgMAUAwNQBAMCvHAA=

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAuA0DALgNAwC4DQMAuA0DAKDiBACg4gQAoOIEAKDiBAA=

qdat:
AAAAAAAAAAAAAAgCAAAAIBAQACQAiCAwCEEGIoDoBmsCgRJoMqheZCjImWNIbTc0TVit3Pwtq3jdV39yStj9Pt19e1/7qW+9zx79Pd2/ef/f216r/5/3r/X3zb/v/7/9te5/+l/n//dn99vXP6f7Mu89vfN7z1/faj7vWz==


formula: Sr Mn2 Si2 O10 H4
compound: <missing>
pub_title: Lawsonite-type phase transitions in hennomartinite, SrMn2[Si2O7](OH)2.H2O T = 245 C
formula_title: <missing>
a: 6.255
b: 9.067
c: 13.431
alpha: 90
beta: 90
gamma: 90
cell_volume: 761.727
crystal_density: 3.642
atoms_sites: ["Sr", "Mn", "Si", "O1", "O2", "O3", "O4", "O5", "Hw", "Hh"]
atoms_x: AAAAAEBCDwAAAAAAAAAAALBmEQAAAAAAAAAAACDFAQAAAAAAAAAAAA==
atoms_y: EBQTAEBCDwDYMjsAYDUBADC5FgAwyAcAQLImAEAJJQAg4SYAALEhAA==
atoms_z: QEIPAAAAAABAEggAQEIPAKADBwAAsAQAgJYCAEBCDwDAFQwAwM4CAA==
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AICEHgAACT0AAAk9AA==
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegD4qQMACH8FAA==
atoms_aniso_label: ["Sr", "Mn", "Si", "O1", "O2", "O3", "O4", "O5"]
atoms_aniso_u11: sGIBAFCqAACAuwAAgLUBAADhAACAUQEA0BoBAEANAwA=
atoms_aniso_u22: wFcBAEC1AACgjAAAwFcBACAWAQCwswAAcMYAACBCAgA=
atoms_aniso_u33: AOEAAACvAAAggAAAUHgAAEAAAQBA5wAAgFEBAKCGAQA=
atoms_aniso_u12: AAAAAMD5//8AAAAAAAAAABDD//8AAAAAAAAAAAAAAAA=
atoms_aniso_u13: AAAAAJABAAAAAAAAAAAAACAcAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u23: AAAAANDV//8AAAAAAAAAABCq//9gOwAAADIAAAAAAAA=
qdat:
AAAAAAAAAAAAAAACAAAAIBAQICABAAAwBEAAAwFICMAEgpRABEAtQBBCKmQYem4gGrFiWqBuM5Gg1q0kn7HinBqy4G2sq3o9OGv2eql947sfJ33HW1d3uN7e1J+8+E2ycxj0iPpc/dZ8xOsaZiErIVh9n9tubW6FqOd8oT==


formula: Si3 Al2 Co3 O12
compound: <missing>
pub_title: Structure and crystal-field spectra of Co3Al2(SiO4)3 and (Mg,Ni)3Al2(SiO4)3 garnet Co3Al2(SiO4)3
formula_title: <missing>
a: 11.4597
b: 11.4597
c: 11.4597
alpha: 90
beta: 90
gamma: 90
cell_volume: 1504.942
crystal_density: 4.475
atoms_sites: ["Si", "Al", "Co", "O"]
atoms_x: YOMWAAAAAAAgoQcAAA0CAA==
atoms_y: AAAAAAAAAAAAAAAAACADAA==
atoms_z: QEIPAAAAAABAQg8AkNknAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Al", "Co", "O"]
atoms_aniso_u11: cCYAALguAABIOgAAwEkAAA==
atoms_aniso_u22: yC0AALguAADIlgAAaFsAAA==
atoms_aniso_u33: yC0AALguAADIlgAA+DQAAA==
atoms_aniso_u12: AAAAABgBAAAAAAAAgCUAAA==
atoms_aniso_u13: AAAAABgBAAAAAAAA0N///w==
atoms_aniso_u23: AAAAABgBAAAAUAAAuPf//w==
qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABABAEAAAgCAAAAIBAQAAgICBAQIAAAgQQIEEEACCACBCCACEEIIQgBACEIRACIABEIQiIBCIBAAiEQEACIAAiIEQAQAAQAAAEAAAAAAAABEAAAAAAAAAAAAAAAAA==


formula: Si3 Al2 Mg2.55 Ni.45 O12
compound: <missing>
formula_title: <missing>
a: 11.4717
b: 11.4717
c: 11.4717
alpha: 90
beta: 90
gamma: 90
cell_volume: 1509.675
crystal_density: 3.683
atoms_sites: ["Si", "Al", "Mg", "Ni", "O"]
atoms_x: YOMWAAAAAAAgoQcAIKEHAIAAAgA=
atoms_y: AAAAAAAAAABwgf//cIH//1ACAwA=
atoms_z: QEIPAAAAAACwww4AsMMOANDfJwA=
atoms_occupancy: AAk9AAAJPQCg8BkA4JMEAAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Al", "Mg", "Ni", "O"]
atoms_aniso_u11: gD4AAJg/AACodQAAqHUAAOhiAAA=
atoms_aniso_u22: yEYAAJg/AADgQQEA4EEBAAB9AAA=
atoms_aniso_u33: yEYAAJg/AADgQQEA4EEBAHhVAAA=
atoms_aniso_u12: AAAAAOj+///4SAAA+EgAAIAlAAA=
atoms_aniso_u13: AAAAAOj+///4SAAA+EgAALgpAAA=
atoms_aniso_u23: AAAAAOj+//9oggEAaIIBAJj0//8=
pub_title:
 Structure and crystal-field spectra of Co3Al2(SiO4)3 and (Mg,Ni)3Al2(SiO4)3
 garnet
 (Mg,Ni)3Al2(SiO4)3

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABACAEAAAgCAAAAICAQABAQEBAgIAABAgQIIEEACCACCCCAEEIIQQgBAEIQhAEIACEQhEIBEICAAiIgEAEQABEQEQAgAAQAAAIAAAAAAAABIAAAAAAAAAAAAAAAAA==


formula: Mg3 O9 Si2
compound: <missing>
formula_title: <missing>
a: 5.323
b: 9.214
c: 21.381
alpha: 90
beta: 90.00
gamma: 90
cell_volume: 1048.655
crystal_density: 2.595
atoms_occupancy: 0
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
pub_title:
 Formation of regularly interstatified serpentine-chlorite minerals by
 tetrahedral inversion in long-period serpentine polytypes

atoms_sites:
["Mg", "Mg", "O", "O", "Si", "O", "O", "O", "O", "Mg", "Mg", "O", "O", "O", "O", "Si", "O", "O", "Mg", "Mg", "O", "O", "O", "O", "Si", "O", "O"]

atoms_x:
AAAAAAAAAABVWBQAVVgUAFVYFABQ3DIAkBUFAKuwKACrsCgAAAAAAAAAAAAAAAAAVVgUALAsCgDwbhkAq7AoAKuwKACrsCgAAAAAAAAAAABVWBQAVVgUALAsCgDwbhkAq7AoAKuwKACrsCgA

atoms_y:
AAAAAFVYFAAAAAAAVVgUAFVYFAAAAAAAQEIPAAAAAABVWBQAAAAAAFVYFAAAAAAAVVgUAAAAAABAQg8AVVgUAAAAAABVWBQAAAAAAFVYFAAAAAAAVVgUAAAAAABAQg8AVVgUAAAAAABVWBQA

atoms_z:
AAAAAAAAAABQAgMAkCEDAODMBwAgfAkAIHwJAJB8EQCQfBEAVVgUAFVYFAAQMxcAEDMXAIAzHwCAMx8AwOIgAFCtJQAQjiUAq7AoAKuwKABwjCsAcIwrAOCMMwDgjDMAIDw1ALAGOgBw5zkA

qdat:
AAAABAAAABAAAACAAAACAACYHAAgAIgAAIIAAQAaEQgAgOMBA2ACQAwEAgAw5hBYBgBgZSBiMAcAIEDIgR0YwFAhhARsygQEAQA0RggIfQkgcCEIASk4YI2ieTDjIgnJxBAgEAgCORckKJ+ShgiYE6ZhBAgIBGi7YiSJ1i==


formula: Cs.88 K.06 Rb.01 Al2.34 Mg.2 Fe.16 Li.14 Si3.16 O11.8 (F.2 H1.8)
compound: <missing>
pub_title: The crystal structure of nanpingite-2M2, the Cs end-member of muscovite
formula_title: <missing>
a: 9.076
b: 5.226
c: 21.41
alpha: 90
beta: 99.48
gamma: 90
cell_volume: 1001.633
crystal_density: 3.191
atoms_x: AAAAAAAAAAAAAAAA0BsFANAbBQDQGwUA0BsFAFBOBwBQTgcA0LQRANC0EQAwqAQAAE8QANCHDADggBwAcCcOABBCOgAQQjoA
atoms_y: kN0FAJDdBQCQ3QUA8EYPAPBGDwDwRg8A8EYPAMDpIwDA6SMAkCgGAJAoBgCgPSIAgA4IAIBDFACgYgcAoFoyAMDIAwDAyAMA
atoms_z: QEIPAEBCDwBAQg8AAAAAAAAAAAAAAAAAAAAAAIDDBwCAwwcA8MEHAPDBBwAQFQMAgBMDAFCmCQDwtQkAkBYJAEDbAgBA2wIA
atoms_occupancy: ALY1AICpAwBAnAAAwMYtAIAaBgAA4gQAwEUEAMA3MABA0QwAwDcwAEDRDAAACT0AAAk9AAAJPQAACT0AAAk9AIDuNgCAGgYA
atoms_u_iso: MGoBADBqAQAwagEAKLQAACi0AAAotAAAKLQAAMjXAADI1wAAyNcAAMjXAACQPAEA4CgBADABAQDgKAEA8HcBAOAoAQDgKAEA
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
atoms_sites:
["Cs", "K", "Rb", "Al2", "Mg2", "Fe2", "Li2", "Si1", "Al1", "Si2", "Al2", "O1", "O2", "O3", "O4", "O5", "O-H6", "F6"]

qdat:
AAAAAAAAAAgAAAAAAAABAAAYQAhAEBABAgAIAAASpICoCgF2QNIAgmIANQQE0TNHYxRhIySaOEoFhIkA/GFl8W3JaHwDZO4yVBhZDVaZOi2ep0Mj1XCNs7Rr6R/z3ajyLlrDRiYnQZIyZ5UcNtzLRjsFpqOWHgwWKq9ms4==


formula: Zn4 S O14 H14
compound: <missing>
formula_title: <missing>
a: 8.330
b: 8.330
c: 10.540
alpha: 90
beta: 90
gamma: 120
cell_volume: 633.375
crystal_density: 2.788
atoms_sites: ["Zn1", "Zn2", "S", "O1", "O2", "O-H1", "O-H2", "Wat1", "Wat2"]
atoms_x: AAAAAGALCACrsCgAq7AoAKCMMgDgO+n/UHX0/wAAAADQxysA
atoms_y: AAAAAOCKKwBVWBQAVVgUAHCPHgAwnAYAkLcDAAAAAADQkgYA
atoms_z: gDQKAGAJAAAA5RAA0LgIAPDEEwCwvvr/kCIHAHB6FQBwzyQA
atoms_occupancy: 0
atoms_u_iso: ABJ6AAASegAAEnoAIHoBACDSAwCAUQEAYMsBANDvAwDg7AoA
atoms_aniso_label: ["Zn1", "Zn2", "S"]
atoms_aniso_u11: oNcAAICJAABwpwEA
atoms_aniso_u22: oNcAAOB5AABwpwEA
atoms_aniso_u33: UMoDAFAVBABQZgMA
atoms_aniso_u12: 0GsAAMArAAC40wAA
atoms_aniso_u13: AAAAAPDx//8AAAAA
atoms_aniso_u23: AAAAAPDx//8AAAAA
pub_title:
 The crystal structure of namuwite, a mineral with Zn in
 tetrahedral and octahedral coordination, and its relationship
 to the synthetic basic zinc sulfates
 Note: U(1,2) for S has been changed to match symmetry constraints.

qdat:
AAAAAAAAAAgAAAEAACABAAAACQAgAhCAgQAQAAIiACIUCAAhCSIJJIgKgEkiQIBIyKsIAMrgTRiMVEkMFUm4CJVypIuUhQhXRYEuOumeDUmKVUkM4bITWpBy8BOxrOcsx12lWmm4qCJTpKw6oVWb2Eddzrcl3ornJmxE7U==


formula: Zn6.938 Cu1.002 (Si S) H19 O21
compound: <missing>
formula_title: <missing>
a: 8.319
b: 8.319
c: 7.377
alpha: 90
beta: 90
gamma: 120
cell_volume: 442.133
crystal_density: 3.503
atoms_sites: ["Zn1", "Cu1", "Zn2", "Si", "S", "H1", "H2", "H3", "O1", "O2", "O-H1", "O-h2", "O-h3"]
atoms_x: 8KAZAPCgGQAAAAAAVVgUAFVYFADAXBUAwAkOAEB3GwBVWBQAAAUUAAAAAAAgiQsAwCwdAA==
atoms_y: 0GkRANBpEQAAAAAAq7AoAKuwKADAzRcAAIgTAIAaBgCrsCgAoNgdAAAAAACA5A4AAFkGAA==
atoms_z: MPj//zD4//9w7w4A8KYYAPCmGAAATB0AgN4PAACmDgBAWgsAwCwdAICEHgCAAgoAgJEHAA==
atoms_occupancy: YDsyAGAxCgAACT0AgIQeAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAATB0AgN4PAACmDgAAEnoAABJ6AAASegAAEnoAABJ6AA==
atoms_aniso_label: ["Zn1", "Cu1", "Zn2", "Si", "S", "O1", "O2", "O-H1", "O-h2", "O-h3"]
atoms_aniso_u11: 4CgBAOAoAQCAOAEA4CICAOAiAgCgAwIAoPcDACAYCQCghgEAIEgBAA==
atoms_aniso_u22: wNoAAMDaAACAOAEA4CICAOAiAgCgAwIAIMUBACAYCQDA1AEAYOoAAA==
atoms_aniso_u33: 4KUBAOClAQDgKAEAoAMCAKADAgBAkAIAIMUBAAB9AABAGQEAwFcBAA==
atoms_aniso_u12: oIwAAKCMAABAnAAAcBEBAHARAQDQAQEAQBMCABCMBACAuwAAIE4AAA==
atoms_aniso_u13: wOD//8Dg//8AAAAAAAAAAAAAAAAAAAAAINH//wAAAACAwf//IE4AAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAYPD//wAAAACgkv//oA8AAA==
pub_title:
 Bechererite, (Zn,Cu)6Zn2(OH)13[(S,Si)(O,OH)4]2, a novel mineral species from the
 Tonopah-Belmont mine, Arizonia
 Note: U(1,2) changed for Si, S, O1, OH1 to match symmetry constraints.

qdat:
AAAAAAAAAAAAAAUAAAAAIAAAAQAAJgABIAAAAAkACgECAhABAEIEoAIABJSDAgQJCgiEUIAiuAgNLIwgCwwIQSK1ZEhHJEEeIoRsuHGWnjUSWJKosdNac/BzgTJ1VjOvU1zvb3jo6aXtZU25d8889ZL/2/mu5Vg/NvnrsR==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.8168
b: 10.4317
c: 5.9650
alpha: 90
beta: 90
gamma: 90
cell_volume: 299.726
crystal_density: 3.191
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: aFAaAAAAAACwkDwAEJQuAEjtCwBIOBEA
atoms_y: mI8FAAAAAABovhAAqC4GAPBTGwAISAoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwDwcQIA
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_aniso_u11: EFkAAHD9AAAwYQAAQH4AAJhsAAAIkwAA
atoms_aniso_u22: EFQAAHh8AQCYTgAAMHoAAPhwAADYgQAA
atoms_aniso_u33: 8FAAAGDgAADYSgAAAHgAAACbAAAAWgAA
atoms_aniso_u12: CP3//1DY///QAgAA0O7//8gAAACQAQAA
atoms_aniso_u13: AAAAAGAOAAAAAAAAAAAAAAAAAACADAAA
atoms_aniso_u23: AAAAAIi0//8AAAAAAAAAAAAAAAAQGAAA
pub_title:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #0, P = 0.0 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAQAAAAAAAgCAAAAJQAAAAUoEECAhBggAwBaADBnAYaCAEEgIELiUQFk6TZAEUokSxVgQnKtMpmjKtKPkosT0PUp7U3dVXVc/3lRbCN8Mdv8m9NV/znb0+uvtnX1/3RuY708df/+9Ze9PXz59J8V==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.8189
b: 10.4373
c: 5.9695
alpha: 90
beta: 90
gamma: 90
cell_volume: 300.244
crystal_density: 3.185
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: +FYaAAAAAACIlTwACKsuALj/CwCgXREA
atoms_y: CI4FAAAAAAAwvxAAgCkGANBVGwAgPwoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwDAbwIA
atoms_occupancy: 0
atoms_u_iso: CFcAAJA8AQAoSwAA0HAAANBwAAAAXwAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #1, P = 0.06 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAwAAAAAAAgCAAAAJQAAAAUoEECBBBBAAgBcADClAYaCAEIgIESiUQKlyjaAEYpEXTegRHK+cpniM1KLNI4j4dVL7U/Z2bbdfapRaCX4MVa9N6Jd/nr7Zs9Oqv/p7ei8x9s87t+9ey82e/m7XTs/==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.8198
b: 10.4378
c: 5.9699
alpha: 90
beta: 90
gamma: 90
cell_volume: 300.334
crystal_density: 3.184
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: AFkaAAAAAADojzwAuLkuAAAmDABgXBEA
atoms_y: iJAFAAAAAADIvRAAcCUGAKBJGwAoQQoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwDAbwIA
atoms_occupancy: 0
atoms_u_iso: KEsAAJA8AQAgUwAA8GQAALh+AADgagAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #2, P = 0.21 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAwAAAAAAAgCAAAAJQAAAAUoEECBBBBAAgBcADClAYaCAEIgIESiUQKlyjaAEZJEXTegRFK6dpniM7MLNI4j4dVL9U/Zmbbd/bqR6CX4Mda9N6Jvfnr75s9equ/p7ei8x9s47t/9+y92e/mz7T8/==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.8190
b: 10.4333
c: 5.9672
alpha: 90
beta: 90
gamma: 90
cell_volume: 300.019
crystal_density: 3.188
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: MGAaAAAAAACghzwA6I4uAJg4DACQQBEA
atoms_y: uI0FAAAAAABQwhAAoB0GAMhTGwB4RgoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwCAZAIA
atoms_occupancy: 0
atoms_u_iso: AF8AADABAQBISQAAqHoAAABfAAAIVwAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #2, P = 0.23 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAwAAAAAAAgCAAAAJQAAAAUoEECBBBhAAwBcADBnAYaCAEEgIEbiUQKl6jaAEUpEXTegRHK9MpliMtKPlIoT0dVL7U/Z1bXc/2lRbCN8MVf9O1Nd7nn71q/Ptv/1vWj8w7s83f+89rc3f7361Ts9==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.8040
b: 10.4117
c: 5.9533
alpha: 90
beta: 90
gamma: 90
cell_volume: 297.771
crystal_density: 3.212
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: QFUaAAAAAABoeTwAEJ4uAKANDABIOBEA
atoms_y: YIEFAAAAAAA4vBAAsA0GAMhJGwDwRgoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwCwZgIA
atoms_occupancy: 0
atoms_u_iso: +FwAAJA8AQAgUwAAiIYAANhyAACohAAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #2, P = 0.99 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAYAAAAAAAgBAAAAEwAAAAUYECCAggggAQAuABhWgMNBACEQECFxKIDSdpcgBGUiLouwIR0+mc7QmWzDzUWJ6HVW/mLWZn2vX2qkWgleDFf/TviVf4629Jrzp39tWXsnqLfLN23/G2XGz142fc/n==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.7996
b: 10.3925
c: 5.9443
alpha: 90
beta: 90
gamma: 90
cell_volume: 296.501
crystal_density: 3.225
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: eEAaAAAAAABogzwA2I8uAOgfDAA4OREA
atoms_y: eIIFAAAAAADouxAAMBUGAAhBGwCINgoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwBYbgIA
atoms_occupancy: 0
atoms_u_iso: KEsAAMiLAQBoPQAAuH4AAFhDAAAoSwAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #1, P = 1.46 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAYAAAAAAAgBAAAAEwAAAAKUCCBAQgwQAQAdAAwzgKHAgCCQCBEomECpcpWgBFKRF03YEJytTKZ4yrSj5KLE/FqrXSrzUzbTvfcqPYR/Bjr/l6pLv8c7fs31cs7+v+6NzHWjju3/3rLzt3ufrdOz==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.7918
b: 10.3784
c: 5.9365
alpha: 90
beta: 90
gamma: 90
cell_volume: 295.229
crystal_density: 3.239
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: UEoaAAAAAADodjwAUIEuANhSDAAIHhEA
atoms_y: uIMFAAAAAAAouBAAyBMGAOA7GwCINgoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwBQWAIA
atoms_occupancy: 0
atoms_u_iso: GFsAADABAQAoSwAA4GoAAPhcAADYaAAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #2, P = 2.17 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAYAAAAAAAQBAAAAEoAAAAKMCCBAQQQQAIAXAAwrQGGggBBICBC4lEBZO0uQAjKJCqXcCE5XRtM0ZltR8pFiehVltbm1qa9r19qlGsJXgxW/07013+OfvTay51f/tXLF6hny5sv9tqz9ufvnzfn9==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.7802
b: 10.3514
c: 5.9224
alpha: 90
beta: 90
gamma: 90
cell_volume: 293.051
crystal_density: 3.263
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: aDcaAAAAAACgaTwA4EsuADBLDAD43RAA
atoms_y: mHYFAAAAAADYtxAAeAQGAIA3GwAQNgoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwAAYgIA
atoms_occupancy: 0
atoms_u_iso: KEsAAIDtAABIPwAAKFUAABhRAABISQAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #2, P = 3.02 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAYAAAAAAAQBAAAACYAAAAFKBBAgIQIIAIAOgAYZoDDQQAhEAghcSiAsnaVIARkkRdNaBCcr0yneMp2oXSSxPo2qX2p+Tqve5/vqSuEX4Mdf9K9Nd/jnb8mevlVd19vxeY2+eXvvfe1vfnr5+t07==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.7717
b: 10.3320
c: 5.9128
alpha: 90
beta: 90
gamma: 90
cell_volume: 291.508
crystal_density: 3.281
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: wDQaAAAAAAAQYzwAqJcuAJCaDADABhEA
atoms_y: KHMFAAAAAAB4uBAAkAUGAOgfGwAAKAoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwCAXwIA
atoms_occupancy: 0
atoms_u_iso: GFsAAIDtAABISQAA0HAAAPBkAADoYgAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #2, P = 3.72 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAIAAAAAAAQAgAAACYAAAAFGBBAgIIIIAEALQAYM4BhwIAgiAgQuJRAWTtLkAIgiIqm/AhOVaZzPCVbMLJBYj4bU17c3NzVvM9v0ovhG+GK76Xeir356/6azSrb/9et0bqO/LGy/2m1fi5+2XP2f==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.7611
b: 10.3072
c: 5.9006
alpha: 90
beta: 90
gamma: 90
cell_volume: 289.564
crystal_density: 3.303
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: 6CAaAAAAAABARzwA4IIuAIiTDADI1hAA
atoms_y: cGcFAAAAAAAAsxAAMPcFAMApGwAAMgoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwAIVQIA
atoms_occupancy: 0
atoms_u_iso: ME0AAKjZAAA4RQAA6GwAAGiSAAD4XAAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #2, P = 4.51 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAMAAAAAAAIAgAAABMAAAADFAggQEEEEACAFwAMGcBg4EAQRAQInEogNJ2lyAERREXTegQnp9O1XhGamH2kWJ6FlW2uXWpV23XttUVwS/Birfp3Iqv8e7fiz086q+W99G6j7xy6ft51n5+u6n82T==


formula: Si Li Sc O4
compound: <missing>
formula_title: LiScSiO4
a: 4.7535
b: 10.2864
c: 5.8895
alpha: 90
beta: 90
gamma: 90
cell_volume: 287.975
crystal_density: 3.321
atoms_sites: ["Si", "Li", "Sc", "O1", "O2", "O3"]
atoms_x: yAkaAAAAAADAOjwAUE8uALCnDABwxRAA
atoms_y: OGMFAAAAAACYsRAAqOgFACghGwDoKwoA
atoms_z: QEIPAAAAAABAQg8AQEIPAEBCDwDgVAIA
atoms_occupancy: 0
atoms_u_iso: QEcAAIDtAABIPwAACGEAANBwAAAYWwAA
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:
 High-pressure crystal chemistry of LiScSiO4: An olivine with nearly isotropic
 compression
 Sample: #2, P = 5.15 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAMAAAAAAAIAgAAABMAAAAChAggQEEGCACADoAGGaAw0EAIBAIESiUQFk6S6ACIEiLpvQITlWmcr4kKzD7ILE9DqrXSnbuq6zl++iI8I7QRfVS7gTf3LX/r1ZNbO3rrvStQ7483bf2dV2ePrRc/Y==


formula: (Mg4.441 Fe2.559) Si8 O24
compound: <missing>
pub_title: Crystal structure of a P2_1/m ferromagnesian cummingtonite at 140 K T = 140 K
formula_title: <missing>
a: 9.492
b: 18.093
c: 5.292
alpha: 90
beta: 102.11
gamma: 90
cell_volume: 888.617
crystal_density: 3.212
atoms_u_iso: 0
atoms_sites:
["Mg1", "Fe1", "Mg2", "Fe2", "Mg3", "Fe3", "Mg4", "Fe4", "Si1a", "Si1b", "Si2a", "Si2b", "O1a", "O1b", "O2a", "O2b", "O3a", "O3b", "O4a", "O4b", "O5a", "O5b", "O6a", "O6b", "O7a", "O7b"]

atoms_x:
AMTw/wDE8P8QufD/ELnw/9DL8P/Qy/D/YJvw/2Cb8P+QWQIAINMgAMDOAgBgiCEAgL/3/3BCFgAAMPj/YOMWAIDY9/9QDRYAANAHABChJgAgKgYAANEkADBRBgBgdiQAQMkFANApJAA=

atoms_y:
EJAUABCQFADgDxoA4A8aAEBCDwBAQg8AYBcfAGAXHwAgbBQAcN8yAICiGQDw/zcAgI4UAGAcMwDgxBkA8Eo4AEBCDwDAxi0AkGAeABCaPADQyBYA8CQ2APAWFwBQhTQAQEIPAMDGLQA=

atoms_z:
gNUdAIDVHQDgVjwA4FY8AJB0PACQdDwAAJcdAACXHQAgBxAAoIoRAIDsLgCQcTAAgCgMACBkDQCQEisAQKcsAKCjKgCwxCsAsKwvAFB3LgDQFAIAEIYFAJBtIACwkCMA0M0RALC9DwA=

atoms_occupancy:
ANQwAAA1DABgmjcAoG4FAGC4MgCgUAoAwLwFAEBMNwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_aniso_label:
["Mg1", "Fe1", "Mg2", "Fe2", "Mg3", "Fe3", "Mg4", "Fe4", "Si1a", "Si1b", "Si2a", "Si2b", "O1a", "O1b", "O2a", "O2b", "O3a", "O3b", "O4a", "O4b", "O5a", "O5b", "O6a", "O6b", "O7a", "O7b"]

atoms_aniso_u11:
mFgAAJhYAAB4XwAAeF8AAJhYAACYWAAAeF8AAHhfAACINgAAeF8AAJhYAACINgAAiDYAAIiBAAB4XwAAaD0AAJijAABYZgAAIEQAAHiqAACYWAAAEG0AAFhmAAAASwAAII8AAOBRAAA=

atoms_aniso_u22:
4DMAAOAzAADQTQAA0E0AANBNAADQTQAAmGcAAJhnAADgMwAA4DMAAOAzAADQTQAAmGcAAPAZAADQTQAA0E0AAJhnAADgMwAA4DMAAHibAACIgQAA0E0AAHibAAB4mwAAiIEAAOAzAAA=

atoms_aniso_u33:
kC4AAJAuAACQLgAAkC4AAPAyAADwMgAAuB8AALgfAABYKgAAGCQAAIgsAAC4HwAAUCgAAEhdAACIYwAAGFsAADhKAABATAAAiGMAAHBOAABATAAA+DQAAKhSAABoPQAA0EMAAPh6AAA=

atoms_aniso_u12:
uPL//7jy//+48v//uPL//wAAAAAAAAAAAAAAAAAAAAAAAAAAuPL//7jy//+48v//AAAAAEgNAABw5f//SA0AAAAAAAAAAAAAcOX//yjY//+48v//SA0AAJAaAACQGgAAAAAAAAAAAAA=

atoms_aniso_u13:
EBMAABATAACoBwAAqAcAAKgHAACoBwAA0BYAANAWAABA/P//KA8AAMADAACY9P//qAcAABATAAD4JQAAqAcAAPglAADAAwAA8Oz//zgiAABoCwAAwAMAAPDs//9Y+P//WPj//8g8AAA=

atoms_aniso_u23:
WAcAAFgHAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABYBwAAKPH//7AdAAAAAAAAsB0AAAAAAAAAAAAAMBYAAFDi//8QSgAA2A4AAFDi///Q6f//AAAAAAAAAAA=

qdat:
AAAAAAAAAAAMCAAAQAAASgEYAbCCEAGgIJaJGEoAXoxo2eOGdBuHHeEZ7rwwm9Ydvg7v7s2UrqXX7I11h5tz3P+dfpe/7Yv2/PVv/f6tbrO///eP1729n23/88/DfnN31/3I//9p1Vb43b32vvea8X1n3vVm5P27r3r8vX==


formula: (Mg4.441 Fe2.559) Si8 O24
compound: <missing>
pub_title: Crystal structure of a P2_1/m ferromagnesian cummingtonite at 140 K T = 295 K
formula_title: <missing>
a: 9.502
b: 18.126
c: 5.309
alpha: 90
beta: 102.07
gamma: 90
cell_volume: 894.172
crystal_density: 3.192
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABQjxEAkCsSACDyBgCAkQcA8PkGADA2FwBQdxUAwFwVABD0FAA=
atoms_y: 0E0FANBNBQDA0AoAwNAKAAAAAAAAAAAAcNAPAHDQDwAQIgUAEE8KAPBQBQDAhQoAAAAAAND4DgAAAggAADoHAAAAAAA=
atoms_z: gIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAgIQeAICEHgCAvxAAsKwvAODHDACg6CsAAEMrAAD5LgDQ7wMAQBsiAGCKEAA=
atoms_occupancy: ANQwAAA1DABgmjcAoG4FAGC4MgCgUAoAwLwFAEBMNwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_u11: mI8AAJiPAABAdAAAQHQAALiIAAC4iAAAEKQAABCkAACgXwAACFIAAOhYAABgbQAAUJYAAADNAADYgQAAUJYAAIi4AAA=
atoms_aniso_u22: EGgAABBoAAAQaAAAEGgAABBoAAAQaAAACLYAAAi2AAD4TQAA+E0AAACCAAAAggAAEGgAABicAAAQ6gAAIFIBAAg0AAA=
atoms_aniso_u33: 4EwAAOBMAABYZgAAWGYAACBiAAAgYgAAiHcAAIh3AADgTAAAgEgAAPBfAACQeQAAyJsAADCiAADAigAAOKQAALgKAQA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAC48v//uPL//wAAAAAAAAAAAAAAALjK//+48v//ACgAAAAAAAA=
atoms_aniso_u13: oB4AAKAeAABQDwAAUA8AAMADAADAAwAAcDUAAHA1AACoBwAAwAMAAFAPAABoCwAAYCIAABATAAAQEwAAQPz//yAmAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACA+P//AAAAAID4///YHQAAAAAAANgOAAA4aAAAoKb//wAAAAA=
atoms_sites:
["Mg1", "Fe1", "Mg2", "Fe2", "Mg3", "Fe3", "Mg4", "Fe4", "Si1", "Si2", "O1", "O2", "O3", "O4", "O5", "O6", "O7"]

atoms_aniso_label:
["Mg1", "Fe1", "Mg2", "Fe2", "Mg3", "Fe3", "Mg4", "Fe4", "Si1", "Si2", "O1", "O2", "O3", "O4", "O5", "O6", "O7"]

qdat:
AAAAAAAAAAAECAAAAAAASAEQAKAAAAGgIQKQAAwAcIgQEQUKgAWGCQIQDjQhM6gI3A2OTLsECIEu2zkQD1amgPkTSjR0kwvImYUWpscsheTTHxMuLoxz9JmczlIW8tGfyXMD+0ftAZalVW5ZTsTFmaVGzUGCBVWFOaJkQ7==


formula: Bi2 Fe1.12 Cu.88 As2 O12
compound: <missing>
formula_title: <missing>
a: 4.581
b: 6.178
c: 8.969
alpha: 94.29
beta: 99.93
gamma: 94.85
cell_volume: 248.102
crystal_density: 5.878
atoms_sites: ["Bi", "Fe1", "Cu2", "Fe2", "As", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: UK0MAAAAAAAAAAAAAAAAALAGIQBAKhMAoNkIAEChFAAg9A4AIOgQAMADDwA=
atoms_y: oAETAAAAAACAhB4AgIQeAODQMAAgfCIAwEktAIC7AAAArA0AoKglAOB7CAA=
atoms_z: UOgXAAAAAAAAAAAAAAAAACBLDQDAFQwA4N42AMAbCwCA6DcAIAUhAOBKJQA=
atoms_occupancy: AAk9AAAJPQAAtjUAAFMHAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0
atoms_aniso_label: ["Bi", "Fe1", "Cu2", "Fe2", "As", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_aniso_u11: cPkEANAzAQCgOwEAoDsBAFBAAQAQUwEAoIwAAKCGAQDgKAEAQBkBAKADAgA=
atoms_aniso_u22: cMABAFBAAQCwFwEAsBcBAJBGAQCAOAEAgLUBAIA4AQAgSAEAAPQBAGBhAgA=
atoms_aniso_u33: sK0BABDQAQBgmQEAYJkBAOCMAQBg5AEAQBMCACBCAgBg5AEAIL8CAKCGAQA=
atoms_aniso_u12: 0EwBABAOAACADAAAgAwAAGAJAACAwf//4LH//0AfAABAHwAAYPD//6APAAA=
atoms_aniso_u13: gBL//7AdAADAEgAAwBIAAGAJAABAHwAAINH//wCD//9AnAAAwOD//0Ci//8=
atoms_aniso_u23: 8CMAAHCUAABgnwAAYJ8AAACWAACAuwAAIMsAAIA+AACAPgAAAIP//6CMAAA=
pub_title:
 Medenbachite, Bi2Fe(Cu,Fe)(O,OH)2(OH)2(AsO4)2, a new mineral species: Its
 description and crystal structure
 Sample: 8.0.376, single Bi atom model

qdat:
AAAAAAAAAAABAAAAAQAAACAJAAAAgAUAAAUCQQAAAhAYAAiCAAQyhCBAiAMEEoALAgIDIkkOLiIjFhAwrTiJgKHJCMFKlvG2VARqYPkbwOgbGuzj3qFOXNq+i5bR6KRf5XU027JNaB/h5xX/7PRJW693Rr56MXvfhv5Ylr==


formula: Bi2 Fe1.12 Cu.88 As2 O12
compound: <missing>
formula_title: <missing>
a: 4.581
b: 6.178
c: 8.969
alpha: 94.29
beta: 99.93
gamma: 94.85
cell_volume: 248.102
crystal_density: 5.878
atoms_sites: ["Bi1", "Bi2", "Fe1", "Cu2", "Fe2", "As", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: 0LIJAFCCDwAAAAAAAAAAAAAAAACwBiEAQCoTAKDZCABAoRQAIPQOACDoEADAAw8A
atoms_y: QEkSAPCrEwAAAAAAgIQeAICEHgDg0DAAIHwiAMBJLQCAuwAAAKwNAKCoJQDgewgA
atoms_z: kCAYADCzFwAAAAAAAAAAAAAAAAAgSw0AwBUMAODeNgDAGwsAgOg3ACAFIQDgSiUA
atoms_occupancy: gIQeAICEHgAACT0AALY1AABTBwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["Bi1", "Bi2", "Fe1", "Cu2", "Fe2", "As", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_aniso_u11: UFkBAOAoAQDQMwEAoDsBAKA7AQBQQAEAEFMBAKCMAACghgEA4CgBAEAZAQCgAwIA
atoms_aniso_u22: EIUBAABFAQBQQAEAsBcBALAXAQCQRgEAgDgBAIC1AQCAOAEAIEgBAAD0AQBgYQIA
atoms_aniso_u33: kJEBACCsAQAQ0AEAYJkBAGCZAQDgjAEAYOQBAEATAgAgQgIAYOQBACC/AgCghgEA
atoms_aniso_u12: wCsAAGAJAAAQDgAAgAwAAIAMAABgCQAAgMH//+Cx//9AHwAAQB8AAGDw//+gDwAA
atoms_aniso_u13: QKL//6Cr//+wHQAAwBIAAMASAABgCQAAQB8AACDR//8Ag///QJwAAMDg//9Aov//
atoms_aniso_u23: wEQAAHBiAABwlAAAYJ8AAGCfAAAAlgAAgLsAACDLAACAPgAAgD4AAACD//+gjAAA
pub_title:
 Medenbachite, Bi2Fe(Cu,Fe)(O,OH)2(OH)2(AsO4)2, a new mineral species: Its
 description and crystal structure
 Sample: 8.0.376, split Bi atom model

qdat:
AAAAAAAAAAABAAAAAQAAACAJAAAAgAUAAAUCQQAAAhAYAAiCAAQyhCAAiAMEEoALAgIDIkkOLiIjFhAwrTiJgKHJCMFKlvG2VARqYPkbwOgbGuzj3qFOXNq+i5bR6KRf5XU027JNaB/h5xX/7PRJW693Tr56MXvfhv5Ylr==


formula: Si Sn Ca O5
compound: <missing>
formula_title: <missing>
a: 7.1535
b: 8.8933
c: 6.6674
alpha: 90
beta: 113.342
gamma: 90
cell_volume: 389.453
crystal_density: 4.552
atoms_sites: ["Si", "Sn", "Ca", "O1", "O2", "O3"]
atoms_x: wMYtAICEHgBAQg8AwMYtAKCgNwBAuBYA
atoms_y: oJ8pAICEHgBwcSgA6NAjAECnIgA4dCsA
atoms_z: gIQeAAAAAACAhB4AAAAAAAA7KQBAVzYA
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Sn", "Ca", "O1", "O2", "O3"]
atoms_aniso_u11: 6D8AAJA4AABA+gEAYFQAAGCVAAAwjgAA
atoms_aniso_u22: oEEAAChBAADwSwAAEFkAAIh8AADAXQAA
atoms_aniso_u33: YEoAADBNAACodQAAYNEAAKhXAABwdgAA
atoms_aniso_u12: AAAAADD9//8AAAAAAAAAAJAuAABgJwAA
atoms_aniso_u13: mBcAAFgWAADY6///cEkAABAYAACwQAAA
atoms_aniso_u23: AAAAAKAAAAAAAAAAAAAAABAYAABACwAA
pub_title:
 A synchrotron radiation, HRTEM, X-ray powder diffraction, and Raman
 spectroscopic study of malayaite, CaSnSiO5

qdat:
AAAAAAAAAAAAAAAAAAABAAAEAAAAAQgBAAQAAABCAEAADAARAIQAAAASFAwEigAhAgAgkSiAKgQBgkEICBgmiAbYCKSAAiSbICcWQiCgkZScAcU0Rj6EplCk0UigOtUfvHkSCT1Axbb5yhkX/3kDZCQO7Zw2bkSOF8Urjf==


formula: Si3 Mg.178 Al1.97 Mn.852 Ca2 O14 H4
compound: <missing>
formula_title: <missing>
a: 8.8510
b: 5.9345
c: 19.1247
alpha: 90
beta: 96.969
gamma: 90
cell_volume: 997.127
crystal_density: 3.309
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:
 Mn crystal chemistry in pumpellyite: A resonant scattering powder diffraction
 Rietveld study using synchrotron radiation
 Sample: SN1

atoms_sites:
["Si1", "Si2", "Si3", "MgX", "AlX", "MnX", "AlY", "MnY", "Ca1", "Ca2", "O1", "O2", "O3", "O4", "O-H5", "O6", "O-H7", "O8", "O9", "O-H10", "O-H11"]

atoms_x:
0MMCAGAxCgCQpBsAgIQeAICEHgCAhB4AIHEPACBxDwCQbw8A8NsLAEAhCABQrhAAgOwVAEDvBwBAvQcA8EgXACCrFgCQ1gIAsNMcAPAkBAAQNR8A

atoms_y:
AAAAAAAAAAAAAAAAQEIPAEBCDwBAQg8AMBsPADAbDwCAhB4AgIQeAGBkDgDAvg0AMDoOAICEHgAAAAAAgIQeAAAAAAAAAAAAgIQeAAAAAACAhB4A

atoms_z:
AHgFAFA3DwAwexgAQEIPAEBCDwBAQg8AoDweAKA8HgAwrBQAIHwJAGCHBACgZA8A4EcZAIAyGwDw+BsAcAUDAMAfAgDA0AoAELMKALBaEwCwQRMA

atoms_occupancy:
AAk9AAAJPQAACT0AQN0KAMAmHgAABRQAQAstAMD9DwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
UKQBAFCkAQBQpAEAoBwCAKAcAgCgHAIAoBwCAKAcAgDgKAEA4CgBAODEAADgxAAA4MQAAODEAADgxAAA4MQAAODEAADgxAAA4MQAAODEAADgxAAA

qdat:
AAAAAEAAAAAgAAAAEAAAAIoBCQAHAACCAQIKggGhFCEoTICDKKZAKAPaETEYVMS5NMQlJgHMtDkrB4sDsmLcj6aZltFbqGM/YKHEu3+OPNl5fPWpbWKrU4ya+89x765ONm8w+hcmqc00YfXb5r4LJ/Ol2JXIFgbZpjZsxj==


formula: Si3 Mg.29 Al2.236 Mn.474 Ca2 O14 H4
compound: <missing>
formula_title: <missing>
a: 8.8330
b: 5.9153
c: 19.1009
alpha: 90
beta: 97.154
gamma: 90
cell_volume: 990.249
crystal_density: 3.259
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:
 Mn crystal chemistry in pumpellyite: A resonant scattering powder diffraction
 Rietveld study using synchrotron radiation
 Sample: SN5

atoms_sites:
["Si1", "Si2", "Si3", "MgX", "AlX", "MnX", "AlY", "MnY", "Ca1", "Ca2", "O1", "O2", "O3", "O4", "O-H5", "O6", "O-H7", "O8", "O9", "O-H10", "O-H11"]

atoms_x:
wJwCAJAQCgAAihsAgIQeAICEHgCAhB4A4B8PAOAfDwBwbA8A0L8LAABNCABwfxAAgAUWANA7CACw1AcAcNgWABDoFgDwrQIAEA8dANAhBADQyh4A

atoms_y:
AAAAAAAAAAAAAAAAQEIPAEBCDwBAQg8AsCcPALAnDwCAhB4AgIQeAIADDgCA0Q0AwNcNAICEHgAAAAAAgIQeAAAAAAAAAAAAgIQeAAAAAACAhB4A

atoms_z:
AHgFAKAyDwAghhgAQEIPAEBCDwBAQg8AYDYeAGA2HgDArRQAwHIJAKBbBAAAPA8AoFoZAMA4GwBw7BsAUOkCAAD0AQDwyAoAgMoKANBdEwCwQRMA

atoms_occupancy:
AAk9AAAJPQAACT0AQLMRAED6GgCAWxAAoL82AGBJBgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
0H4BANB+AQDQfgEAkNwBAJDcAQCQ3AEAkNwBAJDcAQDQfgEA0H4BADCnAAAwpwAAMKcAADCnAAAwpwAAMKcAADCnAAAwpwAAMKcAADCnAAAwpwAA

qdat:
AAAAAEAAAAAgAAAAEAAAAIUBCQAGgACBAQEJggCQiiCURkBBFGMgFAHVCJSOKmJcmXIbkwB2SRySgaTAqTC1RetkZvRa6ijNWDhxLN+lizZeXzVqW1in9NO2vfPWfbmTz5rmPkTolXqtnD1/M1bB5O60uxG5AkDZNMasmM==


formula: Ca6 C1.58 O14.679 Si.84 Cl.498 H7
compound: <missing>
formula_title: <missing>
a: 17.744
b: 22.601
c: 3.633
alpha: 90
beta: 90
gamma: 90
cell_volume: 1456.950
crystal_density: 2.474
pub_title:
 Mechanism of the SiO4 for CO3 substitution in defernite,
 Ca6(CO3)1.58(Si2O7)0.21(OH)7[Cl0.50(OH)0.08(H2O)0.42]: A single-crystal X-ray
 study at 100 K

atoms_sites:
["Ca1", "Ca2", "Ca3", "Ca4", "Ca5", "Ca6", "C1", "O1", "O2", "O3", "Si2", "O4S", "O5S", "O6S", "O7S", "C2", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "Cl1", "OCh2", "OCh3", "OCh4", "OCh5", "H8", "H9", "H10", "H11", "H12", "H13", "H14"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

atoms_aniso_label:
["Ca1", "Ca2", "Ca3", "Ca4", "Ca5", "Ca6", "C1", "O1", "O2", "O3", "O4S", "O5S", "O6S", "O7S", "C2", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "Cl1"]

atoms_aniso_u11:
oIwAAHB7AAAAyAAAMHUAAGCGAACgcwAAsJoAAHB7AABwEQEAAH0AAAB9AABAnAAA4C4AAAB9AAAA+gAAwNoAAAB9AADA2gAAwMEAAPC5AAAwpwAAAMgAAMCoAACQlwAAkLAAAOClAQA=

atoms_aniso_u22:
wNoAAGCGAADAjwAAcHsAAFCqAAAgmQAAgKIAAGCfAAAggAAAQAABAECQAgDAXQAAgLsAACBOAAAgSAEAoIwAAIA4AQBgbQAAACwBAKC+AAAgsgAAIJkAAPC5AACAuwAAQBkBANDoAAA=

atoms_aniso_u33:
wF0AAPBVAADAXQAA8FUAAEBqAADgkgAA8FUAAGCGAAAwpwAAAF4BAEAfAABg6gAAgLsAAEAZAQBAnAAAwNoAAGDqAADgKAEAMMAAAOCrAACgjAAAkJcAANBrAAAwwAAAAMgAAMBFBAA=

atoms_aniso_u12:
UPv//+D8///w2P//EPX//5Do//8w/f//EPX//wDn//9Q+///AAAAACBOAABAHwAAoA8AAGDw//9g8P//gD4AAGDw//8AAAAAMN///0AGAABg8P//cP7//4Dz///w8f//wPn//9AHAAA=

atoms_aniso_u13:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAMDg//8AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACDR//8=

atoms_aniso_u23:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADA4P//AAAAAMBdAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAJDo//8=

qdat:
AAAAAAAAAIABCAAgAAUAAAgCgIgJAVxUkhVqWstB03INgzNf4aa42GDNwu72vzs57/ebfuVccc3pxztGsRuyHKD9LfevMVvf7mPnNVOSf6MwpGAiCAEPrv25v2/ZLu3qq/psUmBQgEAAAAAAf9/5fz+nvrev5syQoQEAAA==


formula: Mg.955 Fe.059 Al.029 Cr.071 Ca.798 K.073 Na.023 Si1.992 O6
compound: <missing>
pub_title: Structure refinement of a natural K-rich diopside: The effect of K on the average structure
formula_title: <missing>
a: 9.7476
b: 8.9478
c: 5.2622
alpha: 90
beta: 106.056
gamma: 90
cell_volume: 441.063
crystal_density: 3.287
atoms_sites: ["Mg1", "Fe1", "Al1", "Cr1", "Ca2", "K2", "Na2", "Mg2*", "Fe2*", "Si", "Al", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAcIgRAHCIEQAgCwcA0BkWAOBfFQA=
atoms_y: UFo3AFBaNwBQWjcAUFo3AABcEgAAXBIAAFwSAAAdEAAAHRAA8KUFAPClBQBQQQUAID8PAGAcAQA=
atoms_z: QEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AwAkOAMAJDgDwoggAEH0TAHC8PAA=
atoms_occupancy: IAQ2AGBnAQAgSAEAYFUEAMC0MACgdAQAYGcBAMBFBACAMgIAgMo8AIA+AAAACT0AAAk9AAAJPQA=
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6ALgDAwC4AwMAABJ6AAASegAAEnoAABJ6AAASegA=
atoms_aniso_label: ["Mg1", "Fe1", "Al1", "Cr1", "Ca2", "K2", "Na2", "Si", "Al", "O1", "O2", "O3"]
atoms_aniso_u11: gHAAAIBwAACAcAAAgHAAAGCfAABgnwAAYJ8AAHB7AABwewAAEIsAAEAZAQDgeQAA
atoms_aniso_u22: wF0AAMBdAADAXQAAwF0AAFCRAABQkQAAUJEAAABkAAAAZAAAgLsAAKCMAABg6gAA
atoms_aniso_u33: oHMAAKBzAACgcwAAoHMAANBrAADQawAA0GsAABCLAAAQiwAAgLsAAOAoAQDgqwAA
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAFD7//9Q+///YAkAAEC7///g/P//
atoms_aniso_u13: sAQAALAEAACwBAAAsAQAAMDg///A4P//wOD///AjAADwIwAA8CMAABByAAAQJwAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAKD2//+g9v//AAAAANDV//+wuf//
qdat:
AAAAAAAAAAAAAAAAQAAAAAIIAAAACAAQIAAEBAAAAKACCEBMEAERQAAAISQkAQEASBo0BCQiCSJIABQwAlDJAHgcvUAiEnERITJSqsJjcJ0xXAEhLbdUYpR8wU8i55NZ91By2ERzaTJe1JSao3FIEqaluBUmXK1HCtgMGC==


formula: Mn2.49 Ca.64 La.25 Ce.25 Pr.05 Nd.17 Sr.04 Si3 Al Fe.1 Cu.01 H O13
compound: <missing>
formula_title: <missing>
a: 8.896
b: 5.706
c: 10.083
alpha: 90
beta: 113.88
gamma: 90
cell_volume: 468.005
crystal_density: 4.213
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:
 Solid solution between piemontite and androsite-(La), a new mineral of the
 epidote group from Andros Island, Greece
 Sample: AND-517
 Note: Mineral name changed from androsite-(La)

atoms_sites:
["Mn1", "Ca1", "La2", "Ce2", "Pr2", "Nd2", "Ca2", "Sr2", "Si1", "Si2", "Si3", "Al1", "Mn1", "Fe1", "Al2", "Mn2", "Fe2", "Cu3", "Mn3", "Fe3", "H", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10"]

atoms_x:
sE4uALBOLgAgJSQAICUkACAlJAAgJSQAICUkACAlJAAAYxUAEFcqADCwCwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACgGhMAoBoTAKAaEwCAGgYAYBMPAEAqEwBAJTEAAIQDAJDvAgDA2wQA0KsfABDYIQBA1yQAkJIFAA==

atoms_y:
wMYtAMDGLQDAxi0AwMYtAMDGLQDAxi0AwMYtAMDGLQDAxi0AQEIPAMDGLQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAQg8AQEIPAEBCDwBAQg8A0JM8ACB8OwDQzwAAQEIPAMDGLQDAxi0AwMYtAEBCDwBAQg8AQEIPAA==

atoms_z:
0E4JANBOCQCwFxoAsBcaALAXGgCwFxoAsBcaALAXGgAAPwIAECURALDXEwAAAAAAAAAAAAAAAACAhB4AgIQeAICEHgCwzwwAsM8MALDPDADAXBUAoJ8BAJD6FQCgLRQA0AkIAACrCQCwsxkAUNIKAGDvFAAgXAYAIHoaAA==

atoms_occupancy:
AJ8kAABqGABAQg8AQEIPAEANAwBAYAoAAKYOAABxAgAACT0AAAk9AAAJPQAAcQIAAKo3AADuAgAAmDoAwFECAEAfAABAnAAAgF85AEANAwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
0LYAANC2AADgqwAA4KsAAOCrAADgqwAA4KsAAOCrAABghgAAAH0AACBnAABgbQAAYG0AAGBtAADQhAAA0IQAANCEAACQyQAAkMkAAJDJAADARQQAcN8AAICiAACQsAAAIIAAAPCgAACQlwAAMNkAALBJAQDgDwEAcHsAAA==

qdat:
AAAAAAAAAAAIBAAAAAAAIEKAACAIAQICgAgICgLACghQHkACigYEwMD4ViKGjgJbaCCrWCFYZleLVZFcS93q3FYGF35hnw/cT/1W+X49uX8T2u/q/S/93v2Zp/6pvvfOe3v9///79/+k2f/Xft/58f9n/OvX9f7x/ff/e/==


formula: Ca.96 Mn.93 Th.02 Sr.19 La.11 Ce.23 Pr.03 Nd.1 Sm.02 Gd.01 Si3 Fe.4 Al1.71 Mg.16 Cu.13 H O13
compound: <missing>
formula_title: <missing>
a: 8.890
b: 5.690
c: 10.135
alpha: 90
beta: 114.44
gamma: 90
cell_volume: 466.732
crystal_density: 3.953
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:
 Solid solution between piemontite and androsite-(La), a new mineral of the
 epidote group from Andros Island, Greece
 Sample: VA-1a

atoms_sites:
["Ca1", "Mn1", "Th2", "Ca2", "Sr2", "La2", "Ce2", "Pr2", "Nd2", "Sm2", "Gd2", "Si1", "Si2", "Si3", "Mn1", "Fe1", "Al1", "Mg1", "Al2", "Mn3", "Fe3", "Cu3", "Al3", "H", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10"]

atoms_x:
YFMuAGBTLgBgRCQAYEQkAGBEJABgRCQAYEQkAGBEJABgRCQAYEQkAGBEJAAA/xQAUBIqAIBgCwAAAAAAAAAAAAAAAAAAAAAAAAAAAMBuEgDAbhIAwG4SAMBuEgDAyAMAkKcOAHDXEgDg0DAA4GcDACC/AgBAhAQAIHUfACAFIQAQjiUAkEcFAA==

atoms_y:
wMYtAMDGLQDAxi0AwMYtAMDGLQDAxi0AwMYtAMDGLQDAxi0AwMYtAMDGLQDAxi0AQEIPAMDGLQAAAAAAAAAAAAAAAAAAAAAAAAAAAEBCDwBAQg8AQEIPAEBCDwBAQg8AkI08ALCWOwDw0gAAQEIPAMDGLQDAxi0AwMYtAEBCDwBAQg8AQEIPAA==

atoms_z:
sEsJALBLCQAA+hkAAPoZAAD6GQAA+hkAAPoZAAD6GQAA+hkAAPoZAAD6GQBwbwIAsAIRAFCcEwAAAAAAAAAAAAAAAAAAAAAAgIQeAPAgDQDwIA0A8CANAPAgDQAg0BQA8P4BAKDWFQBQfRQAkAMIAEBNCQAQWRkAgMoKAGAOFACwRAYA8E8aAA==

atoms_occupancy:
wOQoAEAkFACAOAEAQLMRAMCYCwDAtgYAwAkOAMDUAQCAGgYAgDgBAECcAAAACT0AAAk9AAAJPQCATxIAADUMAIDAFAAAxAkAAAk9AIBPEgAANQwAQO8HAECVFgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
AMgAAADIAAAwwAAAMMAAADDAAAAwwAAAMMAAADDAAAAwwAAAMMAAADDAAAAggAAAkH4AAIBwAABghgAAYIYAAGCGAABghgAAgHAAAODEAADgxAAA4MQAAODEAABADQMAoPAAACCyAAAw2QAAcJQAAEC1AADQnQAAIP0AAABFAQAwPQEAUJEAAA==

qdat:
AAAAAAAAAAAIAgAAAAAAECGAABAEAQEBIAgEBQHgBQQwDoABIgSBUFByKJFCJoE1nBAeTAV0FTPjXqgXI1Ux6q2GAv9IP4L1Dn2Tbz7HTz2ieb++dct//tOYtm/9+79/5fP+be2+rfd2bv3+e+X/H2/b/72+dv+/N/ff83==


formula: Pb18 Ba2 Ca5 Fe2 Mn2 Si30 Cl O96
compound: <missing>
formula_title: <missing>
a: 9.865
b: 9.865
c: 79.45
alpha: 90
beta: 90
gamma: 120
cell_volume: 6696.050
crystal_density: 5.089
atoms_occupancy: 0
atoms_aniso_u11: EL0AAOD2AADAJQEAgLsAAAB9AADAVwEAoIwAAKCMAACAuwAAQB8AAIA+AADAXQAAQB8AAOCrAADgqwAA
atoms_aniso_u22: 8AQBAPCHAAAgFgEAgLsAAAB9AADAVwEAoIwAAKCMAACAuwAAQB8AAGDqAACgjAAAQB8AAGDqAABAGQEA
atoms_aniso_u33: EO8AAGDqAAAgywAAAPoAAOClAQBg5AEAgLsAAKAJAQCAOAEAQJwAAGBtAACAOAEAwNoAAAB9AADAXQAA
atoms_aniso_u12: sE8AAOBgAABguAAAwF0AAIA+AADgqwAAUEYAAFBGAADAXQAAoA8AACBOAAAgTgAAoA8AAOCrAADgqwAA
atoms_aniso_u13: EA4AAHD+//+wBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAKAPAABg8P//AAAAAAAAAADA4P//
atoms_aniso_u23: YAkAANDu//+gDwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGDw//+gDwAAAAAAACDR//8g0f//
pub_title:
 Hyttsjoite, a new, complex layered plumbosilicate with unique tetrahedral sheets
 from Langban, Sweden
 Note: U(1,2) for Ca3 and Fe changed to match symmetry constraints.

atoms_sites:
["Pb1", "Pb2", "Pb3", "Ba", "Ca1", "Ca2", "Ca3", "Fe", "Mn", "Si1", "Si2", "Si3", "Si4", "Si5", "Si6", "Si7", "Cl", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18"]

atoms_x:
AGgpAHBKBADQRhsAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAMCZDwAgmBUAAAAAAACMIwCATSMAAAAAAAAAAAAAvR8AQNcLAEDPNgBgEw8AoDEkAIDGEwDgHAMA4N42AAC+CgDA0isA4KQWAAAAAAAAuAsAAD80AEA1JgBgdygAAAAAAAAAAAA=

atoms_y:
QEAHACBUGAAA4gQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAPAiFQDgQgUAAAAAALAmJAAgNQAAAAAAAAAAAABgKTUAgJAcAGBVBABgeBMAgJYbAMDvOwDgMxQAoFoyAIAmBACAcwwAQBkBAAAAAADgmQMAoPAZAACfJACgAwIAAAAAAAAAAAA=

atoms_z:
eKEnAMBXCwCY6iwAwEQFAAAAAAAADDAA0LYyAKD4BwAAcQIAUKQaAMBPLACwzggAIJAnAKDPEgAAkw0A0OwQAICEHgDAohoAwB0sABAbGwBAqwoA4EQNAGC2EQBgqhMAwHoQADDxFQBAWgsAoK0HAIBwGQCglQsA4AcTAMDLDwAwng4AoC0UAIAdEgA=

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAIE4AACDFAQCAtQEAIE4AACDLAABAnAAAgD4AAECcAABg6gAAYOoAACBOAAAgTgAAIMUBAIA+AABAnAAAAPoAAGDqAADgIgIAgDgBAECcAAA=

atoms_aniso_label:
["Pb1", "Pb2", "Pb3", "Ba", "Ca1", "Ca2", "Ca3", "Fe", "Mn", "Si1", "Si2", "Si3", "Si4", "Si5", "Si6"]

qdat:
AAAAgAABAAABMJAIQAgAASCAOoSBAAAAFSQgBiCAAAGQ+UQAA9RAAHUgaEAAAOyDR2QAdkAAAGnaGkAAOkAABrtAPoAAHIAB6K+gNQAAB8V6A9KgOgAAA6dADUDoPgAO6b4ADQAAHQdeAPgAHgAAHeDwAcAAAAAPOAeAAA==


formula: Ca Al2 Si2 O10 H4
compound: <missing>
pub_title: Effects of temperature and pressure on the structure of lawsonite P = 0.001 kbar, T = 23 C
formula_title: <missing>
a: 8.797
b: 5.852
c: 13.126
alpha: 90
beta: 90
gamma: 90
cell_volume: 675.727
crystal_density: 3.089
atoms_sites: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5", "HW", "H"]
atoms_x: sFQUAEBCDwBQ2DsAAAcDAMAeFwBwZAgAoAYnAMAuJQCAxSgAgO8hAA==
atoms_y: AAAAAEBCDwAAAAAAAAAAAPCkEAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
atoms_z: QEIPAAAAAAAgHggAQEIPACAkBwAw+QMA4OoCAEBCDwAgXxIAQIoDAA==
atoms_occupancy: 0
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegBAfgUAwLYGAA==
atoms_aniso_label: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5"]
atoms_aniso_u11: wMEAAMBdAADQUgAAYIYAAHCUAACAcAAAcHsAAJDiAAA=
atoms_aniso_u22: IJkAADBcAADgYAAAIOQAANCEAAAggAAAoIwAAGBhAgA=
atoms_aniso_u33: QIMAAKBaAACwTwAAsE8AAGCGAAAgZwAAgLsAAACvAAA=
atoms_aniso_u12: AAAAACADAAAAAAAAAAAAAOAVAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: AAAAAFD7//8AAAAAAAAAAFDi//8wEQAAECcAAAAAAAA=
atoms_aniso_u23: AAAAAMD5//8AAAAAAAAAADDf//8AAAAAAAAAAAAAAAA=
qdat:
AAAAAAAAAAAAAAAAgAAAAEABAABACAAAgAABAAERgAAgABADgAQQEEAgAIAFACYFcAIMQBAEhYAMEgMDYHCIQQ6MA4TiBYARNCJUMVegQAmcGB0R1QGECPGz1CIY4ppQJpoYBTTxAFDnEQsdowjmEgJKDFQABgqA5kQZ1j==


formula: Ca Al2 Si2 O10
compound: <missing>
pub_title: Effects of temperature and pressure on the structure of lawsonite P = 0.5 kbar, T = 23 C
formula_title: <missing>
a: 8.789
b: 5.843
c: 13.127
alpha: 90
beta: 90
gamma: 90
cell_volume: 674.126
crystal_density: 3.056
atoms_sites: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5"]
atoms_x: IFMUAEBCDwCg0zsAsAsDANAsFwAgaQgAkPgmAOAxJQA=
atoms_y: AAAAAEBCDwAAAAAAAAAAACCdEAAAAAAAAAAAAAAAAAA=
atoms_z: QEIPAAAAAACQHAgAQEIPANAoBwBg8QMAkO8CAEBCDwA=
atoms_occupancy: 0
atoms_u_iso: YJ8AAKBaAAAQWQAAMHUAAKCMAACAcAAA8KAAAKAJAQA=
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:
AAAAAAAAAAAAAAAAgAAAAEABAABACAAAgAABAAERgAAgABADgAIQEEAgAIADACYDcAEOQAgGg0AMEwMDoFiIII5MAcHhBUAJmhFSETOgQAWWDBSI04CCBLja8hIMY0koNYkEApxYgBgjiIWOsYRzBQC1hikABImAcqEKpR==


formula: Ca Al2 Si2 O10
compound: <missing>
pub_title: Effects of temperature and pressure on the structure of lawsonite P = 28.7 kbar, T = 23 C
formula_title: <missing>
a: 8.717
b: 5.805
c: 13.036
alpha: 90
beta: 90
gamma: 90
cell_volume: 659.650
crystal_density: 3.124
atoms_sites: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5"]
atoms_x: oEYUAEBCDwDQyzsA4BwDAAAMFwCgXAgAYM4mAEA7JQA=
atoms_y: AAAAAEBCDwAAAAAAAAAAAKCpEAAAAAAAAAAAAAAAAAA=
atoms_z: QEIPAAAAAABgJAgAQEIPADAyBwBA7gMAMOYCAEBCDwA=
atoms_occupancy: 0
atoms_u_iso: oL4AABByAABAgwAAYFQAAOCrAACAuwAAgLsAAOAoAQA=
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:
AAAAAAAAAAAAAAAAgAAAACAAgAAgBAAAQAAAgABEYAAIAAQA4ACEBBgEADAAQATArgAhyAEA0HABgmBwLgURBAjkwBgpMCwAWWEUoJqpAgAssGDohpoGECXGVYiIIdlpYF5oMApS4gChRiQWN0YRZiQCzhxkAAoVAKVEHV==


formula: Ca Al2 Si2 O10
compound: <missing>
pub_title: Effects of temperature and pressure on the structure of lawsonite P = 0.001 kbar, T = 444 C
formula_title: <missing>
a: 8.852
b: 5.882
c: 13.194
alpha: 90
beta: 90
gamma: 90
cell_volume: 686.978
crystal_density: 2.999
atoms_sites: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5"]
atoms_x: cE4UAEBCDwBgzTsAsNkCAEArFwDgYggAYBknAOBKJQA=
atoms_y: AAAAAEBCDwAAAAAAAAAAAICmEAAAAAAAAAAAAAAAAAA=
atoms_z: QEIPAAAAAAAgHggAQEIPAHAfBwCwBQQAoOQCAEBCDwA=
atoms_occupancy: 0
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegA=
atoms_aniso_label: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5"]
atoms_aniso_u11: QJYBAEC1AACwmgAA4KUBAAD6AACAuwAAAH0AAGBhAgA=
atoms_aniso_u22: 4CgBAAB9AADwhwAA4KUBAECcAABg6gAAQJwAAEAHBAA=
atoms_aniso_u33: QBkBAECcAABAgwAAgD4AAKAJAQDgqwAA4CgBAIA4AQA=
atoms_aniso_u12: AAAAAEAGAAAAAAAAAAAAAKAPAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: AAAAAFDi//+wBAAAAAAAAOCx//8AAAAAcDAAAAAAAAA=
atoms_aniso_u23: AAAAANDu//8AAAAAAAAAAIDB//8AAAAAAAAAAAAAAAA=
qdat:
AAAAAAAAAAAAAAABAAAAAIACAACAEAABAAACAAImAADAACAKABBAQYCAAgAUAJgVwAgxAEA0HgBgmCgfA0RBCHRgDBUQNACZkRMhGzoEAFnggUkNMAggjps9QUGUMaUGcUGAU04wBRhiIOOaIYzBQCdBioAAwmAZSEUpjA==


formula: Ca Al2 Si2 O10
compound: <missing>
pub_title: Effects of temperature and pressure on the structure of lawsonite P = 0.001 kbar, T = 538 C
formula_title: <missing>
a: 8.860
b: 5.888
c: 13.201
alpha: 90
beta: 90
gamma: 90
cell_volume: 688.666
crystal_density: 2.992
atoms_sites: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5"]
atoms_x: 4EwUAEBCDwDwzjsAwM4CAJAmFwBQYQgAwAknACBqJQA=
atoms_y: AAAAAEBCDwAAAAAAAAAAAACzEAAAAAAAAAAAAAAAAAA=
atoms_z: QEIPAAAAAACQHAgAQEIPAAAhBwAgBAQAINgCAEBCDwA=
atoms_occupancy: 0
atoms_u_iso: ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegA=
atoms_aniso_label: ["Ca", "Al", "Si", "O1", "O2", "O3", "O4", "O5"]
atoms_aniso_u11: YOQBAMDaAABwrQAAYOQBAIA4AQDA2gAAwNoAAMDOAgA=
atoms_aniso_u22: oIYBAECcAADgqwAAYOQBAGDqAADgKAEAIMsAAGDSBAA=
atoms_aniso_u33: gDICAOClAQAAdwEAoAkBAAD0AQCAtQEAQBMCAOAiAgA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: AAAAAIDa//8AAAAAAAAAAOCx//8AAAAAoHMAAAAAAAA=
atoms_aniso_u23: AAAAAFDi//8AAAAAAAAAAIDB//8AAAAAAAAAAAAAAAA=
qdat:
AAAAAAAAAAAAAAABAAAAAIACAACAEAACAAAEAAQmAACAAEAKABBAQQCABgAYAKgWgAgyAIBUHABhGDgbA4SCCKhAHCYwNAEbIhUiFnoEAJPBg5IacBBAjxZ6gkMUY0sM00MAppRgChDEQcc0YhyCgFrDFIACRMAxkIZTmB==


formula: Si1.986 Al.028 O6 Mg1.134 Fe.795 Mn.026 Cr.004 Ti.005 Ca.036
compound: <missing>
formula_title: <missing>
a: 18.316
b: 8.907
c: 5.218
alpha: 90
beta: 90
gamma: 90
cell_volume: 851.268
crystal_density: 3.555
atoms_u_iso: 0
pub_title:
 Orthopyroxene from the Serra de Mage meteorite: A structure-refinement procedure
 for a Pbca phase coexisting with a C2/c exsolved phase
 Sample Opx SDM N.13, natural

atoms_sites:
["SiA", "AlA", "SiB", "AlB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B", "Mg1", "Fe1", "Mn1", "Cr1", "Ti1", "Mg2", "Fe2", "Mn2", "Ca2"]

atoms_x:
ePINAHjyDQBo7hwAaO4cABBLEwAQVSIA8PwSANB+GgCADwwAEE0bACjpFgAo6RYAKOkWACjpFgAo6RYAGBIXABgSFwAYEhcAGBIXAA==

atoms_y:
6D8oAOg/KADQiRQA0IkUAMAlMwCgkRQAMIkeAECdHQBg6S4AYFcMADj1JwA49ScAOPUnADj1JwA49ScA8H4dAPB+HQDwfh0A8H4dAA==

atoms_z:
ALEhAACxIQDghTAA4IUwAICvAgDQkDAAMEoDAACUKgAwyxMAcDkkAPBcNQDwXDUA8Fw1APBcNQDwXDUAmHQWAJh0FgCYdBYAmHQWAA==

atoms_occupancy:
oJs8AMDaAACgmzwAwNoAAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AKC/NgDgjQUA4C4AAIA+AAAgTgAAIHcOAAD4KgBgZwEAgDICAA==

atoms_aniso_label:
["SiA", "AlA", "SiB", "AlB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B", "Mg1", "Fe1", "Mn1", "Cr1", "Ti1", "Mg2", "Fe2", "Mn2", "Ca2"]

atoms_aniso_u11:
IGcAACBnAAAAZAAAAGQAAFB4AAAQWQAAIJkAAACvAAAAlgAAEKQAAECDAABAgwAAQIMAAECDAABAgwAA8KAAAPCgAADwoAAA8KAAAA==

atoms_aniso_u22:
cGIAAHBiAACgWgAAoFoAAGCGAACAiQAAkH4AAPCHAADAwQAAkLAAAPBuAADwbgAA8G4AAPBuAADwbgAAAJYAAACWAAAAlgAAAJYAAA==

atoms_aniso_u33:
IDUAACA1AABwMAAAcDAAADBDAABQRgAAsGgAAPBuAABQXwAAsGgAALA2AACwNgAAsDYAALA2AACwNgAAoEEAAKBBAACgQQAAoEEAAA==

atoms_aniso_u12:
oPb//6D2//8gAwAAIAMAAOD8//9w/v//AOf//5AaAAAAGQAAoPb//3D+//9w/v//cP7//3D+//9w/v//QO3//0Dt//9A7f//QO3//w==

atoms_aniso_u13:
wPn//8D5///A+f//wPn//7AEAADg4///QNT//0AGAABQ+///oPb//6D2//+g9v//oPb//6D2//+g9v//oN3//6Dd//+g3f//oN3//w==

atoms_aniso_u23:
sAQAALAEAABw/v//cP7//5ABAAAwEQAAQAYAAJAaAACwNgAAINH//7AEAACwBAAAsAQAALAEAACwBAAAAAAAAAAAAAAAAAAAAAAAAA==

qdat:
AAAAAAAAAAAEAAAAIAAAAABEgDQABABEDgIIJgEAUmwKgSdzIeCdJSyQ2zaBjbpWX+7S+J/lkf2IvaOxu+yn/duZZ+XKb26NZrXa47++Xq/379Xvx61d71WL33/zb//ebvu3d71722uXmdtfa7/Df3ZcrNmmTcpnP9723d==


formula: Si1.986 Al.028 O6 Mg1.128 Fe.801 Mn.026 Cr.004 Ti.005 Ca.036
compound: <missing>
formula_title: <missing>
a: 18.320
b: 8.917
c: 5.219
alpha: 90
beta: 90
gamma: 90
cell_volume: 852.573
crystal_density: 3.553
atoms_u_iso: 0
pub_title:
 Orthopyroxene from the Serra de Mage meteorite: A structure-refinement
 procedure for a Pbca phase coexisting with a C2/c exsolved phase
 Sample Opx SDM N.7, heated

atoms_sites:
["SiA", "AlA", "SiB", "AlB", "O1A", "O1B", "O2A", "O2B", "O3A", "O3B", "Mg1", "Fe1", "Mn1", "Cr1", "Ti1", "Mg2", "Fe2", "Mn2", "Ca2"]

atoms_x:
cPANAHDwDQAQ7BwAEOwcANBJEwDATyIAYAATAEB4GgBgEQwAEFIbADjtFgA47RYAOO0WADjtFgA47RYAIA8XACAPFwAgDxcAIA8XAA==

atoms_y:
eEEoAHhBKADIhxQAyIcUALAwMwCwnxQAQH4eAICKHQAg/C4AwEcMAADxJwAA8ScAAPEnAADxJwAA8ScAEIcdABCHHQAQhx0AEIcdAA==

atoms_z:
oKchAKCnIQCgfzAAoH8wAMCDAgBwhzAA0CcDAPBsKgDgzxMAQEEkAGBCNQBgQjUAYEI1AGBCNQBgQjUAoF0WAKBdFgCgXRYAoF0WAA==

atoms_occupancy:
oJs8AMDaAACgmzwAwNoAAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AIChLgCAbQ0AYG0AAIA+AAAgTgAAgDcWACB2IwDgKAEAgDICAA==

atoms_aniso_u11:
sE8AALBPAAAgTgAAIE4AAABkAABwSQAAwI8AAECDAABQeAAAQIMAANBrAADQawAA0GsAANBrAADQawAAMI4AADCOAAAwjgAAMI4AAA==

atoms_aniso_u22:
gFcAAIBXAACQTAAAkEwAAOB5AADwhwAAwHYAAKCMAAAgsgAAYJ8AAFBfAABQXwAAUF8AAFBfAABQXwAAAJYAAACWAAAAlgAAAJYAAA==

atoms_aniso_u33:
EEAAABBAAAAwQwAAMEMAAHBiAABAagAAoHMAAFB4AACgcwAAMHUAAEBRAABAUQAAQFEAAEBRAABAUQAAQGoAAEBqAABAagAAQGoAAA==

atoms_aniso_u12:
EPX//xD1//9gCQAAYAkAAJABAABw/v//cOX//zARAADA+f//8PH//+D8///g/P//4Pz//+D8///g/P//0O7//9Du///Q7v//0O7//w==

atoms_aniso_u13:
gPP//4Dz//9w/v//cP7//5ABAAAQ9f//QO3//xD1//9A7f//YPD///Dx///w8f//8PH///Dx///w8f//8Nj///DY///w2P//8Nj//w==

atoms_aniso_u23:
kAEAAJABAABABgAAQAYAAHD+//+wBAAAQB8AAOAVAACwNgAAINH//yADAAAgAwAAIAMAACADAAAgAwAA4Pz//+D8///g/P//4Pz//w==

qdat:
AAAAAAAAAAAEAAAAIAAAAABEgDQABABIDgIIJgEAUmwKgSdyIeGpZTiQ2zcBlfp2b3bS8J/Jkf6IvyKyu9zv9Z6b5udK766P6qVz5a9+W1/3T217xb79718b+//X777er9739/6v63Ovsv/Wt9eH3XpdrbFu39ztP9b7ed==


formula: Ca S O6 D4
compound: <missing>
pub_title: Thermal expansion of gypsum investigated by neutron powder diffraction T = 4.2 K
formula_title: <missing>
a: 5.6740
b: 15.1049
c: 6.4909
alpha: 90
beta: 118.513
gamma: 90
cell_volume: 488.829
crystal_density: 2.394
atoms_sites: ["Ca", "S", "O1", "O2", "Ow", "D1", "D2"]
atoms_x: gIQeAAAAAACI2DoA+D0uAPBmFwDoew8AyL8YAA==
atoms_y: YOEEAPitBABQGwgA0FYBAMCFCgBwKwoAKPEOAA==
atoms_z: QEIPAMDGLQAgliEAOIsoAHgvHACo/B4AkBoeAA==
atoms_occupancy: 0
atoms_u_iso: YBMAAKAUAADAOgAAeDcAAPg+AACoGgEA2P4AAA==
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:
AAAAAAAAAAAAABAAAAAAAAQgAAACAEAAAIEACAAKECgAQEgAEAKABAIkBAEQgiAIABMGg7BigVCAlAUEQoAIpSAk2QAApGAREgYIPlAiINF8D4SgECJyBlCQxxYKCgl4EoRsCggq2CcgwOkBwA7XUGBh3bHCBo6JIibQgR==


formula: Ca S O6 D4
compound: <missing>
pub_title: Thermal expansion of gypsum investigated by neutron powder diffraction T = 150 K
formula_title: <missing>
a: 5.6742
b: 15.1236
c: 6.5018
alpha: 90
beta: 118.495
gamma: 90
cell_volume: 490.357
crystal_density: 2.387
atoms_sites: ["Ca", "S", "O1", "O2", "Ow", "D1", "D2"]
atoms_x: gIQeAAAAAAD40ToAaDwuADBUFwCIdw8ACLcYAA==
atoms_y: gN8EAFiyBADgHAgAEFMBAEggCwDQ5AkAsOsOAA==
atoms_z: QEIPAMDGLQCwnCEAuI0oAEAXHADY6h4AoA8eAA==
atoms_occupancy: 0
atoms_u_iso: 8CgAAOAuAAAQdwAAgGYAAFidAAAgegEACFYBAA==
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:
AAAAAAAAAAAAABAAAAAAAAQgAAACAEAAAQEACAASEEgAQIgAIAKABAIoCAIwgkAIABIHBtDDAZCBFAoMgwAQxSAteQAByKASJAQILKBEQaF4HwlAEIbSDEEgjSoUCAxoIgiYHBBdkDVCg8wCgBS+kSBlpUNMDR4SJGXAgk==


formula: Ca S O6 D4
compound: <missing>
pub_title: Thermal expansion of gypsum investigated by neutron powder diffraction T = 320 K
formula_title: <missing>
a: 5.6769
b: 15.2074
c: 6.5277
alpha: 90
beta: 118.494
gamma: 90
cell_volume: 495.279
crystal_density: 2.363
atoms_sites: ["Ca", "S", "O1", "O2", "Ow", "D1", "D2"]
atoms_x: gIQeAAAAAACgsToAUDYuAAgYFwD4SA8AKI0YAA==
atoms_y: wMwEAADOBABYGAgAkFABAFgkCwBw2wkAONwOAA==
atoms_z: QEIPAMDGLQCApCEA2JooAIBoHADwkR4AuOgdAA==
atoms_occupancy: 0
atoms_u_iso: 0HAAALBjAAD46AAACMAAABhaAQCQuAIASGACAA==
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:
AAAAAAAAAAAAABAAAAAAAARAAAAEAEAAAgEAEAAkIIgAQSAAQAUAEARwEAhBCIAIAEoODMESBhICMCgaCQBAkYB1ogAGI0AoUBgQ4kCZAwMwelMAQiokGwiDVViQMBGgVMWQcETqoFMRFRAWAVr2MEJNyxjQTPEE5V4CLD==


formula: Si2.84 Al1.08 Fe.35 Ti.06 Mg2.67 (K.96 Ba.01 Na.03) O11.96 F.04 H1.8
compound: <missing>
formula_title: <missing>
a: 5.318
b: 9.214
c: 10.279
alpha: 90
beta: 100.01
gamma: 90
cell_volume: 496.004
crystal_density: 2.877
atoms_x: EKUEABClBAAQpQQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAoNcAANAMFABg8gcAoBEIAKARCACgEQgA
atoms_y: cCsKAHArCgBwKwoAAAAAAAAAAAAAAAAAMEgUADBIFAAwSBQAgIQeAICEHgCAhB4AAAAAAODzDQBALgoAgIQeAICEHgCAhB4A
atoms_z: aO4NAGjuDQBo7g0AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAA8GQKAPBkCgBA2hcAoEcYAKBHGACgRxgA
atoms_occupancy: wFUrAMB6EACAOAEAgDgBAEB+BQBAUjYAgDgBAEB+BQBAUjYAAJg6AECcAADA1AEAAAk9AAAJPQAACT0AgO42AIA4AQAA4gQA
atoms_u_iso: 0
atoms_aniso_u11: OA0BADgNAQA4DQEAyFQBAMhUAQDIVAEAwCABAMAgAQDAIAEAaMwCAGjMAgBozAIAiDQCAAjiAQAgJQEAgCkBAIApAQCAKQEA
atoms_aniso_u22: eBMBAHgTAQB4EwEAiF0BAIhdAQCIXQEAMBoBADAaAQAwGgEAyNUCAMjVAgDI1QIAuKABAPhBAgDoIAEA8E8BAPBPAQDwTwEA
atoms_aniso_u33: SDQBAEg0AQBINAEA+LUBAPi1AQD4tQEA4GQBAOBkAQDgZAEA8P4BAPD+AQDw/gEAuKUBAOBkAQAAbQEAoFQBAKBUAQCgVAEA
atoms_aniso_u12: QPz//0D8//9A/P//AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAJiz//8AAAAAAAAAAAAAAAAAAAAA
atoms_aniso_u13: 2GgAANhoAADYaAAAKIIAACiCAAAoggAA2GgAANhoAADYaAAAqI4AAKiOAACojgAAgHUAAPB9AADYaAAA2GgAANhoAADYaAAA
atoms_aniso_u23: qPj//6j4//+o+P//AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAKDT//+o+P//AAAAAAAAAAAAAAAA
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tas27-2Ba

atoms_sites:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "Ba", "Na", "O1", "O2", "O3", "O-H4", "F4", "O4"]

atoms_aniso_label:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "Ba", "Na", "O1", "O2", "O3", "O-H4", "F4", "O4"]

qdat:
AAAAAAAAAAIAAAAAAAAACACgAgCAAACgAQAAAAEEgKAgAEyQSAoCIQCgEAASMmqCBAYDRoCYIgQhEwA9iCmUkPkGCwCl4UZBRoxfCUNlay19gNYjQvx0Xxkrl0T176Tpp2Yg3vBMhlmkvosY+kxgs8ttYSNSV5mmgmTuxZ==


formula: Si2.84 Al1.04 Fe.39 Ti.06 Mg2.67 (K.96 Na.03 Ba.01) O11.96 F.04 H1.8
compound: <missing>
formula_title: <missing>
a: 5.330
b: 9.2346
c: 10.3010
alpha: 90
beta: 99.92
gamma: 90
cell_volume: 499.439
crystal_density: 2.865
atoms_x: cKQEAHCkBABwpAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAYNEAAJAGFABA7wcA4BcIAOAXCADgFwgA
atoms_y: iCwKAIgsCgCILAoAAAAAAAAAAAAAAAAAQEcUAEBHFABARxQAgIQeAICEHgCAhB4AAAAAAMDwDQCwLAoAgIQeAICEHgCAhB4A
atoms_z: 4O4NAODuDQDg7g0AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAgGYKAPBkCgBg3RcAgEQYAIBEGACARBgA
atoms_occupancy: wFUrAIDeDwDA1AEAgDgBAEB+BQBAUjYAgDgBAEB+BQBAUjYAAJg6AMDUAQBAnAAAAAk9AAAJPQAACT0AgO42AIA4AQAA4gQA
atoms_u_iso: 0
atoms_aniso_u11: sGgAALBoAACwaAAAcJQAAHCUAABwlAAAAHgAAAB4AAAAeAAACEsCAAhLAgAISwIAWJwBAPgfAQCglgAAoJYAAKCWAACglgAA
atoms_aniso_u22: +GsAAPhrAAD4awAAcJQAAHCUAABwlAAASIAAAEiAAABIgAAAWEsCAFhLAgBYSwIAQOwAAPh5AQAAhwAACKIAAAiiAAAIogAA
atoms_aniso_u33: EHIAABByAAAQcgAAoMMAAKDDAACgwwAAGKsAABirAAAYqwAAWFYBAFhWAQBYVgEAoMMAAKDDAAC4kgAAuJIAALiSAAC4kgAA
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAANCj///oAwAAAAAAAAAAAAAAAAAA
atoms_aniso_u13: UBkAAFAZAABQGQAAaC4AAGguAABoLgAAiB0AAIgdAACIHQAASD8AAEg/AABIPwAAUBkAAEg/AAD4JQAA4BAAAOAQAADgEAAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAPja//+o+P//AAAAAAAAAAAAAAAA
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tas27-2Bb

atoms_sites:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "Na", "Ba", "O1", "O2", "O3", "O-H4", "F4", "O4"]

atoms_aniso_label:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "Na", "Ba", "O1", "O2", "O3", "O-H4", "F4", "O4"]

qdat:
AAAAAAAAAAIAAAAAAAAACACgAgEAAACgAgAAAAIFAaBAAJkQkBQCQgFAIAAkZNUECAwGjQEwJAjCRgB3IFUpIbQUKgGbxx0DmjE6IwycvLS2A1mNBfHQ/GaqXRPTrpKmvZiDvcN6GaKV3CyjonCDk23liJmK3MqUEyXaL5==


formula: Si2.76 Al1.2 Fe.73 Ti.12 Mg2.16 Mn.09 K.92 Ba.04 O11.94 F.06 H1.68
compound: <missing>
formula_title: <missing>
a: 5.333
b: 9.238
c: 10.267
alpha: 90
beta: 99.96
gamma: 90
cell_volume: 498.193
crystal_density: 2.994
atoms_u_iso: 0
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tag15-4

atoms_sites:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Mn1", "Ti2", "Fe2", "Mg2", "Mn2", "K", "Ba", "O1", "O2", "O3", "O-H4", "F4", "O4"]

atoms_x:
sJsEALCbBACwmwQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGDRAADQDBQAgPUHACAFCAAgBQgAIAUIAA==

atoms_y:
ICsKACArCgAgKwoAAAAAAAAAAAAAAAAAAAAAAGBZFABgWRQAYFkUAGBZFACAhB4AgIQeAAAAAAAQ7A0AYDEKAICEHgCAhB4AgIQeAA==

atoms_z:
ONgNADjYDQA42A0AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAABBoCgBAYAoAoOMXANA/GADQPxgA0D8YAA==

atoms_occupancy:
QB0qAIBPEgBAnAAAAHECAMAJDgAA8isAQJwAAABxAgDACQ4AAPIrAABxAgAAJzgAAHECAAAJPQAACT0AAAk9AABFMwDA1AEAQO8HAA==

atoms_aniso_label:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Mn1", "Ti2", "Fe2", "Mg2", "Mn2", "K", "Ba", "O1", "O2", "O3", "O-H4", "F4", "O4"]

atoms_aniso_u11:
wOkAAMDpAADA6QAAkOcAAJDnAACQ5wAAkOcAAGDlAABg5QAAYOUAAGDlAAAQLwIAEC8CADgMAgAAnwEAyA4BAOgbAQDoGwEA6BsBAA==

atoms_aniso_u22:
uAABALgAAQC4AAEAwBsBAMAbAQDAGwEAwBsBABAwAQAQMAEAEDABABAwAQCwZgIAsGYCAKCpAQAwIwIAOEQBAHgiAQB4IgEAeCIBAA==

atoms_aniso_u33:
sOoAALDqAACw6gAAqDMBAKgzAQCoMwEAqDMBAEgbAQBIGwEASBsBAEgbAQAQrQEAEK0BAABUAQCoMwEAaCMBABADAQAQAwEAEAMBAA==

atoms_aniso_u12:
qAcAAKgHAACoBwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAC4p///WPj//wAAAAAAAAAAAAAAAA==

atoms_aniso_u13:
CCoAAAgqAAAIKgAAsDYAALA2AACwNgAAsDYAANAlAADQJQAA0CUAANAlAAAQVAAAEFQAACgZAACwNgAAeDIAAEAuAABALgAAQC4AAA==

atoms_aniso_u23:
qPj//6j4//+o+P//AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAD42v//qPj//wAAAAAAAAAAAAAAAA==

qdat:
AAAAAAAAAAIAAAAAAAAACACgAgEAAACgAQAAAAEFAOBAAJUQkBIBIQCgEAASZEYECA4FhYEwFARglgBXIFXIoVIUHQGOQxlBigieMwKGtpyUgdjDA7nYqOZOXTPRnTF6i4iBXWG1GSMU7Q0zsnCBcTbziM5IxEOcHiO5Jr==


formula: (Si2.76 Al1.24) Ti.12 Fe.6 Mg2.19 K.92 Ba.02 O11.94 F.06 H1.92
compound: <missing>
formula_title: <missing>
a: 5.329
b: 9.228
c: 10.258
alpha: 90
beta: 100.03
gamma: 90
cell_volume: 496.738
crystal_density: 2.917
atoms_x: gKMEAICjBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGDqAACwCRQAcOcHAMD7BwDA+wcAwPsHAA==
atoms_y: ICsKACArCgAAAAAAAAAAAAAAAADwWhQA8FoUAPBaFACAhB4AgIQeAAAAAABg5w0AoDcKAICEHgCAhB4AgIQeAA==
atoms_z: cNwNAHDcDQCAhB4AgIQeAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAALBeCgAgXQoAQNoXAOA0GADgNBgA4DQYAA==
atoms_occupancy: QB0qAMDrEgAAcQIAADUMAECOLAAAcQIAADUMAECOLAAAJzgAgDgBAAAJPQAACT0AAAk9AACYOgDA1AEAQJwAAA==
atoms_u_iso: 0
atoms_aniso_u11: 4GkBAOBpAQAIRwEACEcBAAhHAQCINQEAiDUBAIg1AQBQYgIAUGICAMijAgAgCwIAOJ4BAMBcAQDAXAEAwFwBAA==
atoms_aniso_u22: eF4BAHheAQAANgEAADYBAAA2AQCYQwEAmEMBAJhDAQBYmwIAWJsCACC2AQCwQwIAqI0BAGivAQBorwEAaK8BAA==
atoms_aniso_u33: 6JMBAOiTAQDokwEA6JMBAOiTAQCogwEAqIMBAKiDAQBYLQIAWC0CAJDcAQDgBAIAWFsBADhTAQA4UwEAOFMBAA==
atoms_aniso_u12: qAcAAKgHAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADIef//4BoAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u13: OIYAADiGAABQmwAAUJsAAFCbAABQmwAAUJsAAFCbAAAA6wAAAOsAAAgqAAC4+wAAsE8AAPB9AADwfQAA8H0AAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAB44v//WAcAAAAAAAAAAAAAAAAAAA==
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tag15-3

atoms_sites:
["Si", "Al", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "Ba", "O1", "O2", "O3", "O-H4", "F4", "O4"]

atoms_aniso_label:
["Si", "Al", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "Ba", "O1", "O2", "O3", "O-H4", "F4", "O4"]

qdat:
AAAAAAAAAAIAAAAAAAAACACgAgEAAACQAQAAAAEFAOAgAJUIkBIBIQCgEAATUmcECAYDRMCQCgJgkwBNEDOokPkMDoFPIY0gxQRfOYPDm45KgOyjgdzcVLMvLJn4yphtpcRgzqDajFFKdI5a9TjBGKp1zGMkZ2GGC6HMkz==


formula: (Si2.72 Al1.28) Ti.18 Fe.87 Mg1.89 Mn.03 (K Ba) O11.98 F.02 H1.74
compound: <missing>
formula_title: <missing>
a: 5.3405
b: 9.244
c: 10.253
alpha: 90
beta: 100.09
gamma: 90
cell_volume: 498.337
crystal_density: 3.905
atoms_x: QJ0EAECdBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAPoAAPD2EwBwAAgAUP0HAFD9BwBQ/QcA
atoms_y: iCwKAIgsCgAAAAAAAAAAAAAAAAAAAAAA8FoUAPBaFADwWhQA8FoUAICEHgCAhB4AAAAAAND+DQDwMgoAgIQeAICEHgCAhB4A
atoms_z: YNMNAGDTDQCAhB4AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAgGYKAHBYCgBg3RcAQD4YAEA+GABAPhgA
atoms_occupancy: AIEpAACIEwCAqQMAQLMRAMBzJgBAnAAAgKkDAECzEQDAcyYAQJwAAAAJPQAACT0AAAk9AAAJPQAACT0AwBk1AECcAAAAUwcA
atoms_u_iso: 0
atoms_aniso_u11: WPcAAFj3AABY9wAAWPcAAFj3AABY9wAAOOoAADjqAAA46gAAOOoAANBkAgDQZAIAKA0CAIioAQBoDwEAGAABABgAAQAYAAEA
atoms_aniso_u22: sEQBALBEAQBgMAEAYDABAGAwAQBgMAEAaEsBAGhLAQBoSwEAaEsBAACyAgAAsgIAAMwBAAhaAgAAWQEACHQBAAh0AQAIdAEA
atoms_aniso_u33: qEIBAKhCAQDYYgEA2GIBANhiAQDYYgEA4FoBAOBaAQDgWgEA4FoBAHAkAgBwJAIAoLMBABhzAQDgWgEAqEIBAKhCAQCoQgEA
atoms_aniso_u12: GPz//xj8//8AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAFCr//9Y+P//AAAAAAAAAAAAAAAA
atoms_aniso_u13: wDoAAMA6AADYTwAA2E8AANhPAADYTwAAsDYAALA2AACwNgAAsDYAAEhYAABIWAAAeDIAABBUAAAwQwAACCoAAAgqAAAIKgAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHji//8AAAAAAAAAAAAAAAAAAAAA
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tpg63-2B

atoms_sites:
["Si", "Al", "Ti1", "Fe1", "Mg1", "Mn1", "Ti2", "Fe2", "Mg2", "Mn2", "K", "Ba", "O1", "O2", "O3", "O-H4", "F4", "O4"]

atoms_aniso_label:
["Si", "Al", "Ti1", "Fe1", "Mg1", "Mn1", "Ti2", "Fe2", "Mg2", "Mn2", "K", "Ba", "O1", "O2", "O3", "O-H4", "F4", "O4"]

qdat:
AAAAAAAAAAIAAAAAAAAABADAAgEAAACQAQAAAAEJAOBAAJUIkBIBIQCgCAATpEYECA4FjUCwDAKgkgBOIFbwoWkUCoGWY5UhxgSubAOHHRWegM0jga00XGYvmTLxzJDLj5TBzyFSmNMV/I0ValGBMftpmKYw5kGMK0d4zr==


formula: Si2.84 Al1.04 Fe.36 Ti1.87 Mg.89 (K.93 Ba.02 Na.05) O12 H1.82
compound: <missing>
formula_title: <missing>
a: 5.321
b: 9.211
c: 10.287
alpha: 90
beta: 99.93
gamma: 90
cell_volume: 496.631
crystal_density: 3.164
atoms_x: gKMEAICjBACAowQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAwKgAAAAeFABg8gcAgA4IAIAOCAA=
atoms_y: eC0KAHgtCgB4LQoAAAAAAAAAAAAAAAAAgEMUAIBDFACAQxQAgIQeAICEHgCAhB4AAAAAAEDkDQAgKwoAgIQeAICEHgA=
atoms_z: eO0NAHjtDQB47Q0AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAgGYKAIBmCgCA4BcAEEYYABBGGAA=
atoms_occupancy: wFUrAIDeDwDA1AEAwNQBAADiBABAUjYAwNQBAADiBABAUjYAQMM4AIA4AQBADQMAAAk9AAAJPQAACT0AwIo3AEB+BQA=
atoms_u_iso: 0
atoms_aniso_u11: 6N8AAOjfAADo3wAAyPUAAMj1AADI9QAAyPUAAMj1AADI9QAAsGsCALBrAgCwawIAKPQBAECqAQBg/gAAAPoAAAD6AAA=
atoms_aniso_u22: UBMBAFATAQBQEwEAMC4BADAuAQAwLgEAeCcBAHgnAQB4JwEASKYCAEimAgBIpgIAGHgBAOgLAgDoNAEAoDsBAKA7AQA=
atoms_aniso_u33: IMsAACDLAAAgywAASAwBAEgMAQBIDAEAwPMAAMDzAADA8wAAqGUBAKhlAQCoZQEAaBQBACgEAQDA8wAAaBQBAGgUAQA=
atoms_aniso_u12: WPj//1j4//9Y+P//AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAALCv//9oCwAAAAAAAAAAAAA=
atoms_aniso_u13: 6DoAAOg6AADoOgAAID8AACA/AAAgPwAAsDYAALA2AACwNgAAaEcAAGhHAABoRwAAqAwAAIBcAAB4MgAAMEMAADBDAAA=
atoms_aniso_u23: qPj//6j4//+o+P//AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAKDT//+o+P//AAAAAAAAAAA=
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tae23-1a

atoms_sites:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Ti2", "K", "Ba", "Na", "O1", "O2", "O3", "O-H4", "O4"]

atoms_aniso_label:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Ti2", "K", "Ba", "Na", "O1", "O2", "O3", "O-H4", "O4"]

qdat:
AAAAAAAAAAIAAAAAAAAACACgAgEAAACgAQAAAAEEgKAgAEyQiAwCIQCgEAASMm0EBA4CRoEYIgQhJgA5iEu0kOoKFgEt4sqBTRRemYZNTl57AbTDhLRcahNPm0zl1aVTdmpBffDYirGlbQ0w6LxBZZtawmWi5jLNB0jciW==


formula: Si2.84 Al1.12 Fe.34 Ti.09 Mg2.61 K.88 Ba.01 Na.05 O12 H1.82
compound: <missing>
formula_title: <missing>
a: 5.330
b: 9.230
c: 10.256
alpha: 90
beta: 99.92
gamma: 90
cell_volume: 497.010
crystal_density: 2.856
atoms_x: 8KEEAPChBADwoQQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAK8AAAAeFABA7wcAMBMIADATCAA=
atoms_y: ECwKABAsCgAQLAoAAAAAAAAAAAAAAAAAUEsUAFBLFABQSxQAgIQeAICEHgCAhB4AAAAAACDhDQBALgoAgIQeAICEHgA=
atoms_z: AOgNAADoDQAA6A0AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAoGkKADBrCgBg3RcAgEQYAIBEGAA=
atoms_occupancy: wFUrAAAXEQBAnAAAwNQBAIAaBgDAGTUAwNQBAIAaBgDAGTUAALY1AECcAABADQMAAAk9AAAJPQAACT0AwIo3AEB+BQA=
atoms_u_iso: 0
atoms_aniso_u11: CMAAAAjAAAAIwAAAOMIAADjCAAA4wgAAqLsAAKi7AACouwAAcFECAHBRAgBwUQIAIO0BABCAAQDg4gAAEOUAABDlAAA=
atoms_aniso_u22: yNcAAMjXAADI1wAAyNcAAMjXAADI1wAAOOUAADjlAAA45QAA6HkCAOh5AgDoeQIAoF4BAHjlAQDQ8gAA+AYBAPgGAQA=
atoms_aniso_u33: IKwBACCsAQAgrAEAgMQBAIDEAQCAxAEAgMQBAIDEAQCAxAEA0FUCANBVAgDQVQIA0OwBAPD0AQBAtAEAuNwBALjcAQA=
atoms_aniso_u12: 6AMAAOgDAADoAwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAALin//8AAAAAAAAAAAAAAAA=
atoms_aniso_u13: QC4AAEAuAABALgAAwDoAAMA6AADAOgAACCoAAAgqAAAIKgAA2E8AANhPAADYTwAA8BQAAKBLAACINgAA+D4AAPg+AAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAMjT//8AAAAAAAAAAAAAAAA=
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tae23-1b

atoms_sites:
["Si", "Al", "Fe", "Ti", "Fe", "Mg", "Ti", "Fe", "Mg", "K", "Ba", "Na", "O1", "O2", "O3", "O-H4", "O4"]

atoms_aniso_label:
["Si", "Al", "Fe", "Ti", "Fe", "Mg", "Ti", "Fe", "Mg", "K", "Ba", "Na", "O1", "O2", "O3", "O-H4", "O4"]

qdat:
AAAAAAAAAAIAAAAAAAAACACgAgEAAACQAQAAAAEFAOBAAJUIkBIBIQCgEAASZGcECA4FRMCwDARgkgBPEFWooPoMDoFPYZVAhgydKwKCnYzegMzCgdisXLJuXJn4jpDuzszBz6DalLOMdI6T61DBOTLqjKUoZEKMDSNYll==


formula: Si2.8 Al1.16 Fe.37 Ti.09 Mg2.58 K.87 Ba.02 Na.05 O11.98 F.02 H1.8
compound: <missing>
formula_title: <missing>
a: 5.318
b: 9.219
c: 10.274
alpha: 90
beta: 99.88
gamma: 90
cell_volume: 496.229
crystal_density: 2.874
atoms_x: gKMEAICjBACAowQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEKQAAGAOFABgCwgAkBwIAJAcCACQHAgA
atoms_y: MCoKADAqCgAwKgoAAAAAAAAAAAAAAAAAgEMUAIBDFACAQxQAgIQeAICEHgCAhB4AAAAAALDiDQBgMQoAgIQeAICEHgCAhB4A
atoms_z: uOQNALjkDQC45A0AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAIHYKAMBsCgAA7RcA8EIYAPBCGADwQhgA
atoms_occupancy: gLkqAECzEQBAnAAAwNQBAMC2BgCAfTQAwNQBAMC2BgCAfTQAwBk1AIA4AQBADQMAAAk9AAAJPQAACT0AgO42AECcAABAfgUA
atoms_u_iso: 0
atoms_aniso_u11: KK4BACiuAQAorgEA6LYBAOi2AQDotgEAMKEBADChAQAwoQEA4DADAOAwAwDgMAMA6CMDAIBVAgAQ+AEAuEoCALhKAgC4SgIA
atoms_aniso_u22: sEkBALBJAQCwSQEASGsBAEhrAQBIawEA2F0BANhdAQDYXQEA2M8CANjPAgDYzwIA+AUCAFh4AgCAyQEAKDUCACg1AgAoNQIA
atoms_aniso_u33: +HQBAPh0AQD4dAEA2K0BANitAQDYrQEAuKUBALilAQC4pQEASB8CAEgfAgBIHwIAuKUBAFDWAQDgZAEAMM4BADDOAQAwzgEA
atoms_aniso_u12: QPz//0D8//9A/P//AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEC7//8AAAAAAAAAAAAAAAAAAAAA
atoms_aniso_u13: UDIAAFAyAABQMgAA6FMAAOhTAADoUwAAUDIAAFAyAABQMgAAkGAAAJBgAACQYAAAMEMAAJBgAABgHQAAmCEAAJghAACYIQAA
atoms_aniso_u23: qPj//6j4//+o+P//AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAo8f//AAAAAAAAAAAAAAAA
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tae23-1c

atoms_sites:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "Ba", "Na", "O1", "O2", "O3", "O-H4", "F4", "O4"]

qdat:
AAAAAAAAAAIAAAAAAAAACACgAgEAAACgAQAAAAEEgKAgAEyQiAoCIQCgEAASUmsCBAYDRoEQIgRhEgA5iEu4kNoKFwDN4cqBxRRfGYJFXi5egLxCgqh8bxMvnkzt16jTLkpg/eDcipEldQ0w+JxBJZt64mWiZjKtB0lciX==


formula: Si2.92 Al.72 Fe.69 Ti.03 Mg2.64 K.99 O11.92 F.08 H1.86
compound: <missing>
formula_title: <missing>
a: 5.338
b: 9.247
c: 10.300
alpha: 90
beta: 99.96
gamma: 90
cell_volume: 500.751
crystal_density: 2.907
atoms_x: YKAEAGCgBABgoAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAKClAADQJRQAQO8HAHAZCABwGQgAcBkIAA==
atoms_y: ECwKABAsCgAQLAoAAAAAAAAAAAAAAAAAUEsUAFBLFABQSxQAgIQeAAAAAADA1w0AYDEKAICEHgCAhB4AgIQeAA==
atoms_z: iOINAIjiDQCI4g0AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AAAAAAHBxCgDAbAoAYN0XAMBKGADAShgAwEoYAA==
atoms_occupancy: QI4sAID8CgBAfgUAQJwAAMC2BgAAtjUAQJwAAMC2BgAAtjUAwGw8AAAJPQAACT0AAAk9AEDDOAAAcQIAwNQBAA==
atoms_u_iso: 0
atoms_aniso_u11: MBoBADAaAQAwGgEAEA0BABANAQAQDQEAIAIBACACAQAgAgEAyLcCAKhkAgBYDwIA4AoBAPD/AADw/wAA8P8AAA==
atoms_aniso_u22: OBwBADgcAQA4HAEA6AcBAOgHAQDoBwEAMAEBADABAQAwAQEAoMYCAFjnAQCgUwIAgBUBAMgOAQDIDgEAyA4BAA==
atoms_aniso_u33: 6AwBAOgMAQDoDAEACBUBAAgVAQAIFQEAKB0BACgdAQAoHQEAuK8BAKg9AQCoPQEAoAQBAOgMAQDoDAEA6AwBAA==
atoms_aniso_u12: 6AMAAOgDAADoAwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACoo///AAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u13: 2DYAANg2AADYNgAAoDIAAKAyAACgMgAA2DYAANg2AADYNgAAYFQAAKgMAACYWAAAaC4AAKAyAACgMgAAoDIAAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAB40///AAAAAAAAAAAAAAAAAAAAAA==
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tpq16-4A

atoms_sites:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "O1", "O2", "O3", "O-H4", "F4", "O4"]

atoms_aniso_label:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "O1", "O2", "O3", "O-H4", "F4", "O4"]

qdat:
AAAAAAAAAAIAAAAAAAAACADABAEAAACgAgAAAAIJAcBAAJkQkBQCQgFAIAAkpM4IEAwEiwFgJAjCRAB2IKdSQaQYKgKehTUDGjE8Zg0NrSk2AtEOC2FRcsS8uSK3OqNtuREDOoJ0KcYl9DnG4sEFlulLEZSjuY0oJkVkWb==


formula: Si2.84 Al1.12 Fe.28 Ti.09 Mg2.67 K.98 Ba.02 Na.01 O11.9 F.1 H1.74
compound: <missing>
formula_title: <missing>
a: 5.332
b: 9.239
c: 10.291
alpha: 90
beta: 99.94
gamma: 90
cell_volume: 499.349
crystal_density: 2.861
atoms_x: mKQEAJikBACYpAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAK8AADAWFACA9QcAwBQIAMAUCADAFAgA
atoms_y: OCwKADgsCgA4LAoAAAAAAAAAAAAAAAAA4EwUAOBMFADgTBQAgIQeAICEHgCAhB4AAAAAAGDnDQBALgoAgIQeAICEHgCAhB4A
atoms_z: +OoNAPjqDQD46g0AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AAAAAAAAAAAAAAAAA0GEKAEBgCgCA4BcAwEoYAMBKGADAShgA
atoms_occupancy: wFUrAAAXEQBAnAAAwNQBAADiBABAUjYAwNQBAADiBABAUjYAgNA7AIA4AQBAnAAAAAk9AAAJPQAACT0AwBk1AEANAwAA4gQA
atoms_u_iso: 0
atoms_aniso_u11: aG8AAGhvAABobwAAIIUAACCFAAAghQAAyHMAAMhzAADIcwAAgAUCAIAFAgCABQIAGJYBAHgiAQBwlAAAwKMAAMCjAADAowAA
atoms_aniso_u22: cIAAAHCAAABwgAAAeJsAAHibAAB4mwAAeJsAAHibAAB4mwAAECoCABAqAgAQKgIAAPoAAHB6AQAwogAA8MMAAPDDAADwwwAA
atoms_aniso_u33: SIoAAEiKAABIigAAaNMAAGjTAABo0wAACLsAAAi7AAAIuwAAsF0BALBdAQCwXQEAaNMAAKjjAACImgAAKMMAACjDAAAowwAA
atoms_aniso_u12: 6AMAAOgDAADoAwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAPCI//9Y+P//AAAAAAAAAAAAAAAA
atoms_aniso_u13: UBkAAFAZAABQGQAAMCoAADAqAAAwKgAAGBUAABgVAAAYFQAAoDIAAKAyAACgMgAA6Or//8hLAABQGQAAUBkAAFAZAABQGQAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHjT//8AAAAAAAAAAAAAAAAAAAAA
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tpt17-1

qdat:
AAAAAAAAAAIAAAAAAAAACACgAgEAAACgAQAAAAIFAaBAAJkQkBQCQgFAIAAkZM4ECAwGjYEwJAjBJgBfIFXxIaIUKgGKwxqDihk6IwSM/pS+AXiFBfHQukS+XTPTvlHqnZiBvcF6GWMU2h1jYmCCk2TliJpJ3MqUEifSJ9==


formula: Si3.12 Fe1.09 Mg2.7 (K.99 Na.01) O11.86 F.14 H1.78
compound: <missing>
formula_title: <missing>
a: 5.357
b: 9.270
c: 10.319
alpha: 90
beta: 99.96
gamma: 90
cell_volume: 504.712
crystal_density: 2.943
atoms_sites: ["Si", "Fe", "Fe1", "Mg1", "Fe2", "Mg2", "K", "Na", "O1", "O2", "O3", "O-H4", "F4", "O4"]
atoms_x: 8KEEAPChBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA0D4UAJDRBwCgKggAoCoIAKAqCAA=
atoms_y: sCwKALAsCgAAAAAAAAAAAFBLFABQSxQAgIQeAICEHgAAAAAAwIwNAFA8CgCAhB4AgIQeAICEHgA=
atoms_z: wNcNAMDXDQCAhB4AgIQeAICEHgCAhB4AAAAAAAAAAADQegoAsHcKANDbFwDgTRgA4E0YAOBNGAA=
atoms_occupancy: gJsvAIBtDQDARQQAgO42AMBFBACA7jYAwGw8AECcAAAACT0AAAk9AAAJPQBAUjYAwEUEAABxAgA=
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Fe", "Fe1", "Mg1", "Fe2", "Mg2", "K", "Na", "O1", "O2", "O3", "O-H4", "F4", "O4"]
atoms_aniso_u11: KPAAACjwAABQ3AAAUNwAADjlAAA45QAAOO0CADjtAgB4nQMASBkDAICnAABgCAEAYAgBAGAIAQA=
atoms_aniso_u22: 8HwBAPB8AQBYbwEAWG8BAIiKAQCIigEACFkDAAhZAwDIGwMA2D0DAMBhAQCogwEAqIMBAKiDAQA=
atoms_aniso_u33: 6D4BAOg+AQBAHgEAQB4BAEAeAQBAHgEA4FQCAOBUAgA42gEA4FQCAAhHAQBQTwEAUE8BAFBPAQA=
atoms_aniso_u12: kAsAAJALAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA4MX//xj8//8AAAAAAAAAAAAAAAA=
atoms_aniso_u13: QBUAAEAVAACQ9///kPf//3AIAABwCAAAKIwAACiMAACogP//0JgAADDz//+A1f//gNX//4DV//8=
atoms_aniso_u23: gPj//4D4//8AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAKOL//4AHAAAAAAAAAAAAAAAAAAA=
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tas22-1a

qdat:
AAAAAAAAAAIAAAAAAAAACADABAEAAAFAAgAAAAIKAUCAASohICgEhAJAQABJSZwQEBgNEgTASBGCWAFogVWkh8hQdAorDGoEKGTpiBQ1/OakDsY4H49DaRLy5ZqI6o7sbEwd/g3JSzil0Os7IwwXE29YjOUKxGiBoisUTR==


formula: Si3.08 Fe1.16 Mg2.76 (K.98 Na.02) O11.94 F.06 H1.78
compound: <missing>
formula_title: <missing>
a: 5.358
b: 9.277
c: 10.308
alpha: 90
beta: 99.99
gamma: 90
cell_volume: 504.603
crystal_density: 2.969
atoms_sites: ["Si", "Fe", "Fe1", "Mg1", "Fe2", "Mg2", "K", "Na", "O1", "O2", "O3", "O-H4", "F4", "O4"]
atoms_x: sJsEALCbBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADAEgAA4GUUAFD9BwAgHggAIB4IACAeCAA=
atoms_y: ECwKABAsCgAAAAAAAAAAAABQFAAAUBQAgIQeAICEHgAAAAAAUI4NAGAxCgCAhB4AgIQeAICEHgA=
atoms_z: gNYNAIDWDQCAhB4AgIQeAICEHgCAhB4AAAAAAAAAAADQYQoAQGAKAODpFwAQRhgAEEYYABBGGAA=
atoms_occupancy: QP8uAMAJDgAA4gQAACc4AADiBAAAJzgAgNA7AIA4AQAACT0AAAk9AAAJPQBAUjYAwNQBAADiBAA=
atoms_u_iso: 0
atoms_aniso_label: ["Si", "Fe", "Fe1", "Mg1", "Fe2", "Mg2", "K", "Na", "O1", "O2", "O3", "O-H4", "F4", "O4"]
atoms_aniso_u11: GA8BABgPAQCYNAEAmDQBALgKAQC4CgEAgHgCAIB4AgBoAwMASKsCAEgRAQA4ZwEAOGcBADhnAQA=
atoms_aniso_u22: sCsBALArAQAoQAEAKEABAGAXAQBgFwEAQKkCAECpAgBAXgIAcMQCAJDnAACgVAEAoFQBAKBUAQA=
atoms_aniso_u33: ID4BACA+AQCQhwEAkIcBAKhWAQCoVgEA0DICANAyAgCwKgIAyPkBAAhvAQAIbwEACG8BAAhvAQA=
atoms_aniso_u12: GPz//xj8//8AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAsKr//zD4//8AAAAAAAAAAAAAAAA=
atoms_aniso_u13: SF0AAEhdAABQbgAAUG4AAPBpAADwaQAAaIMAAGiDAADYVAAAGKEAAFBuAAAwfwAAMH8AADB/AAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAeLX//wAAAAAAAAAAAAAAAAAAAAA=
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tas22-1b

qdat:
AAAAAAAAAAIAAAAAAAAACAFABAEAAAEgAgAAAAIKAcCAASohICgEhAJAIABNSZwQIBgOEwLASBGCSAF4gVtChchgdAprDGkGOCT5WBYd7KT0BkY0DM1DZxLyyZ6M6Y5sfEwc6g2pSxivSMk+owwTE2q4jOMORDiB4juSyy==


formula: Si3.16 Al.04 Fe1.22 Ti.03 Mg2.55 K.95 Na.02 O11.9 F.1 H1.56
compound: <missing>
formula_title: <missing>
a: 5.356
b: 9.284
c: 10.309
alpha: 90
beta: 100.03
gamma: 90
cell_volume: 504.782
crystal_density: 2.979
atoms_x: QJ0EAECdBABAnQQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADgRwAAgEMUAGDyBwBwGQgAcBkIAHAZCAA=
atoms_y: 6CsKAOgrCgDoKwoAAAAAAAAAAAAAAAAAkFEUAJBRFACQURQAgIQeAICEHgAAAAAA4KgNAPAyCgCAhB4AgIQeAICEHgA=
atoms_z: yNQNAMjUDQDI1A0AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AAAAAAAAAAABwWAoAsF4KANDbFwCgRxgAoEcYAKBHGAA=
atoms_occupancy: wDcwAECcAAAANQwAQJwAAICLCABA4TMAQJwAAICLCABA4TMAwPs5AIA4AQAACT0AAAk9AAAJPQCAmy8AQA0DAEBgCgA=
atoms_u_iso: 0
atoms_aniso_u11: QFUBAEBVAQBAVQEAoFkBAKBZAQCgWQEAGDIBABgyAQAYMgEAaLMCAGizAgCY7AIAaOoCALBOAQBwVwEAcFcBAHBXAQA=
atoms_aniso_u22: COgAAAjoAAAI6AAASNoAAEjaAABI2gAAWLEAAFixAABYsQAAID0CACA9AgBANgIA8GwCALDMAACwzAAAsMwAALDMAAA=
atoms_aniso_u33: CG8BAAhvAQAIbwEAsI8BALCPAQCwjwEACG8BAAhvAQAIbwEAsCoCALAqAgAICgIACAoCALCPAQBwfwEAcH8BAHB/AQA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgLL//wAAAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: sFQAALBUAACwVAAAgGEAAIBhAACAYQAAEFkAABBZAAAQWQAAuGUAALhlAABAFQAAgJgAAEhdAACwVAAAsFQAALBUAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA0Lz//4AHAAAAAAAAAAAAAAAAAAA=
pub_title:
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tpq16-6B

atoms_sites:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "Na", "O1", "O2", "O3", "O-H4", "F4", "O4"]

atoms_aniso_label:
["Si", "Al", "Fe", "Ti1", "Fe1", "Mg1", "Ti2", "Fe2", "Mg2", "K", "Na", "O1", "O2", "O3", "O-H4", "F4", "O4"]

qdat:
AAAAAAAAAAIAAAAAAAAACAFABAEAAAEgAgAAAAISAcCAATIhICQEhAGAIAAtSZwQIBgOFQLASBOCWAE8gVtChUhQNARrFGkOKCdx1A4dfPTUBkY0HMXk5zP6yZ+M6Y9ceEYU6g2oxxCuROkeo4wTk2q0jOKGZCjB8j+a7S==


formula: O22.54 (F1.46 Si6.28) Al2.5 Mg3.79 Fe.45 Ti.02 Ca4.73 Mn.08 Na.7 K.05 H.54
compound: <missing>
formula_title: <missing>
a: 9.816
b: 17.899
c: 5.297
alpha: 90
beta: 105.35
gamma: 90
cell_volume: 897.465
crystal_density: 3.563
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:
 A new hyper-calcic amphibole with Ca at the A site: Fluor-cannilloite from
 Pargas, Finland
 Sample: C1

atoms_sites:
["O1", "O2", "O-H3", "F3", "O4", "O5", "O6", "O7", "Si1", "Al1", "Si2", "Mg1", "Fe1", "Mg2", "Al2", "Ti2", "Fe2", "Mg3", "Fe3", "Ca4", "Mn4", "Fe4", "Ca4*", "Mn4*", "Fe4*", "NaA", "KA", "CaA", "NaAm", "KAm", "CaAm", "NaA2", "KA2", "CaAm"]

atoms_x:
kHMGAFBOBwBAkQYAQJEGAKBsFgDAjhUAkBkVADAQFQCwNBEAsDQRAPDQEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAALAkAwCwJAMAsCQDAAAAAAAAAAAAAAAAAA==

atoms_y:
MFcFACCPCgAAAAAAAAAAANBcDwDQnwgAcB8HAAAAAADwNwUA8DcFABCaCgDgdAUA4HQFABCzCgAQswoAELMKABCzCgAAAAAAAAAAADAPEQAwDxEAMA8RAJA3EACQNxAAkDcQAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeALCIHACwiBwAsIgcAA==

atoms_z:
wCgNAPD2LABQoisAUKIrAPAvMABQAwcA4HwlALDQEABAlBIAQJQSAMDHMQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAAAAAAJClBgCQpQYAkKUGAAAAAAAAAAAAAAAAAA==

atoms_occupancy:
AAk9AAAJPQDAehAAQI4sAAAJPQAACT0AAAk9AAAJPQBAyiIAwD4aAAAJPQCAXzkAgKkDAEDoHQDAzRcAQJwAAMC2BgBAwzgAwEUEAEA0OwCAOAEAQJwAAEA0OwCAOAEAQJwAAICLCABAnAAAQGAKAICLCABAnAAAQGAKAICLCABAnAAAQGAKAA==

atoms_u_iso:
UKAAAJiKAADowQAA6MEAAAi2AADYxwAAwNUAAGDvAADoYgAA6GIAAOhiAADYcgAA2HIAAMhuAADIbgAAyG4AAMhuAADYcgAA2HIAAHiMAAB4jAAAeIwAAGgOAgBoDgIAaA4CALDJAwCwyQMAsMkDABDoAgAQ6AIAEOgCAOCHAQDghwEA4IcBAA==

qdat:
AAAAAAAAAAACEAAAAAAAFAQKAgIAAAAYQCgRAEAgC0KBQFBQNAgVLFiCEBuGAm+A0F4LRKbmgIMpIuh0AQvAhNBvkdUWAeOwnlNCW1czKyRmJG+pvSaBif+07hvkQ4H6tRaenJAr2qhgeLgVolBDTCFJmp0izAsQBnDovT==


formula: O22.46 (F1.54 Si5.64) Al3.18 Mg3.72 Fe.52 Ti.02 Ca4.58 Mn.08 Na.55 K.2 H.46
compound: <missing>
formula_title: <missing>
a: 9.826
b: 17.906
c: 5.301
alpha: 90
beta: 105.41
gamma: 90
cell_volume: 899.150
crystal_density: 3.554
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:
 A new hyper-calcic amphibole with Ca at the A site: Fluor-cannilloite from
 Pargas, Finland
 Sample: C2

atoms_sites:
["O1", "O2", "O-H3", "F3", "O4", "O5", "O6", "O7", "Si1", "Al1", "Si2", "Mg1", "Fe1", "Mg2", "Al2", "Ti2", "Fe2", "Mg3", "Fe3", "Ca4", "Mn4", "Fe4", "Ca4*", "Mn4*", "Fe4*", "NaA", "KA", "CaA", "NaAm", "KAm", "CaAm", "NaA2", "KA2", "CaA2"]

atoms_x:
UG0GAKBJBwAAiwYAAIsGADBuFgAwjRUAkBkVAIALFQBwLhEAcC4RAGDPEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACEAwAAhAMAAIQDAAAAAAAAAAAAAAAAAA==

atoms_y:
4FsFAECSCgAAAAAAAAAAAGBeDwDwoggAcB8HAAAAAAAQOwUAEDsFAKCbCgBwdgUAcHYFABCzCgAQswoAELMKABCzCgAAAAAAAAAAAFASEQBQEhEAUBIRAHA0EABwNBAAcDQQAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAICQHACAkBwAgJAcAA==

atoms_z:
ECQNADD9LABQoisAUKIrADA2MACQCQcAwJIlAODhEAAQnBIAEJwSALDSMQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAAAAAAMBlBwDAZQcAwGUHAAAAAAAAAAAAAAAAAA==

atoms_occupancy:
AAk9AAAJPQDACQ4AQP8uAAAJPQAACT0AAAk9AAAJPQBABhkAwAIkAAAJPQBAwzgAwEUEAMCvHABABhkAQJwAAMC2BgAAJzgAAOIEAACYOgCAOAEAgDgBAEDDOACAOAEAgDgBAMC2BgAAcQIAAMQJAMC2BgAAcQIAAMQJAMC2BgAAcQIAAMQJAA==

atoms_u_iso:
YJoAAKiEAAD4uwAA+LsAABiwAAAYugAAyM0AAHDzAAAAXwAAAF8AABhbAADIbgAAyG4AAPBkAADwZAAA8GQAAPBkAADobAAA6GwAAJCIAACQiAAAkIgAAKDhAACg4QAAoOEAALgqBAC4KgQAuCoEAAgVAQAIFQEACBUBAEgaAgBIGgIASBoCAA==

qdat:
AAAAAAAAAAACEAAAAAAAGAQKAgIAAAAYQCgRAEAgC0KCQGBQNAglLFiCEBuGAm8A4F4NRMbmgIIpIqh4AQvBDeDdoVsWAePQnlNC2ncyOixuZHex/0aBia8orhPEQ4H/tTacnJAy3SigcLgVotBDlCNJrZ1jWAoQBrCo7T==


formula: O22.66 (F1.34 Si5.68) Al3.16 Mg3.66 Fe.48 Ti.02 Ca4.68 Mn.12 Na.6 K.25 H.66
compound: <missing>
formula_title: <missing>
a: 9.836
b: 17.921
c: 5.306
alpha: 90
beta: 105.40
gamma: 90
cell_volume: 901.712
crystal_density: 3.565
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:
 A new hyper-calcic amphibole with Ca at the A site: Fluor-cannilloite from
 Pargas, Finland
 Sample: C3

atoms_sites:
["O1", "O2", "O-H3", "F3", "O4", "O5", "O6", "O7", "Si1", "Al1", "Si2", "Mg1", "Fe1", "Mg2", "Al2", "Ti2", "Fe2", "Mg3", "Fe3", "Ca4", "Mn4", "Ca4*", "Mn4*", "NaA", "KA", "CaA", "NaAm", "KAm", "CaAm", "NaA2", "KA2", "CaA2"]

atoms_x:
UG0GAKBJBwCwjwYAsI8GADBuFgAwjRUA4BQVAEAFFQDgLBEA4CwRAPDQEQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQLgMAEC4DABAuAwAAAAAAAAAAAAAAAAA=

atoms_y:
AF8FANCTCgAAAAAAAAAAAPBfDwBgoQgAACEHAAAAAAAQOwUAEDsFAKCbCgAAeAUAAHgFAKC0CgCgtAoAoLQKAKC0CgAAAAAAAAAAAAAXEQAAFxEAQG4QAEBuEACAhB4AgIQeAICEHgCAhB4AgIQeAICEHgCwiBwAsIgcALCIHAA=

atoms_z:
oCUNAFAALQAApysAAKcrAIAxMACQCQcAwJIlANDsEACgnRIAoJ0SANDVMQCAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAACwwQYAsMEGALDBBgAAAAAAAAAAAAAAAAA=

atoms_occupancy:
AAk9AAAJPQBAJBQAwOQoAAAJPQAACT0AAAk9AAAJPQCAohkAgGYjAAAJPQAAJzgAAOIEAEB3GwCAohkAQJwAAABTBwAAJzgAAOIEAEA0OwDA1AEAQDQ7AMDUAQAAUwcAQA0DAADECQAAUwcAQA0DAADECQAAUwcAQA0DAADECQA=

atoms_u_iso:
UKAAAJiKAAAQuAAAELgAABiwAAAQuAAAyM0AAGD5AAAAXwAAAF8AABhbAADobAAA6GwAAPBkAADwZAAA8GQAAPBkAADobAAA6GwAAMh4AADIeAAAiOUAAIjlAACw3AQAsNwEALDcBADQSwIA0EsCANBLAgBwUgEAcFIBAHBSAQA=

qdat:
AAAAAAAAAAACEAAAAAAAGAQMAgIAAAAwQDAhAEAgC0MCQGCQOAgmSLCEMCsMAnUBoGwOSMWvAQIpY9h4AReBDaDdI3IqA8PhPKSEvGpkVkjMyNqjdksBE9dp3CfIhoP/ank1OyBt2VEh4XA7LeCHGELU+hPGsBwgH2FR2q==


formula: O22.46 F1.54 Si6.12 Al2.32 Mg4.32 Ti.04 Fe.2 Ca2.25 Na.75 K.65 H2
compound: <missing>
formula_title: <missing>
a: 9.889
b: 17.978
c: 5.298
alpha: 90
beta: 105.41
gamma: 90
cell_volume: 908.040
crystal_density: 3.204
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:
 A new hyper-calcic amphibole with Ca at the A site: Fluor-cannilloite from
 Pargas, Finland
 Sample: BMS

atoms_sites:
["O1", "O2", "O-h3", "F3", "O4", "O5", "O6", "O7", "Si1", "Al1", "Si2", "Mg1", "Mg2", "Al2", "Ti2", "Fe2", "Mg3", "Fe3", "Al3", "Ca4", "NaA", "KA", "CaA", "NaAm", "KAm", "CaAm", "NaA2", "KAm", "CaA2", "H"]

atoms_x:
gH4GABBIBwAAcgYAAHIGAMBWFgBwYRUAUBMVALDRFADgExEA4BMRAPC3EQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACQ9QEAkPUBAJD1AQAAAAAAAAAAAAAAAACATQoA

atoms_y:
gFIFAOCICgAAAAAAAAAAAMBODwAggggA8CsHAAAAAADwNwUA8DcFANCTCgDAcQUAwLcKAMC3CgDAtwoAwLcKAAAAAAAAAAAAAAAAAMAQEQCAhB4AgIQeAICEHgCAhB4AgIQeAICEHgAQ3RwAEN0cABDdHAAAAAAA

atoms_z:
sEwNADCyLADwmCsA8JgrAMBQMACQ1wYA4EolAPCFEQAwnxIAMJ8SAFCwMQCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAICEHgAAAAAAAAAAAAAAAAAQKAQAECgEABAoBAAAAAAAAAAAAAAAAAAgEycA

atoms_occupancy:
AAk9AAAJPQDACQ4AQP8uAAAJPQAACT0AAAk9AAAJPQBAWSAAwK8cAAAJPQAACT0AwFUrAID8CgCAOAEAQH4FAIDuNgCAOAEAAOIEAAAJPQDAJwkAQO8HAEANAwDAJwkAQO8HAEANAwDAJwkAQO8HAEANAwAACT0A

atoms_u_iso:
aJIAAJiKAABonAAAaJwAACCyAAD4xQAA+MUAAFD1AAAIYQAACGEAAPhmAADYaAAA+GYAAPhmAAD4ZgAA+GYAAMhuAADIbgAAyG4AAGiSAAAotAAAKLQAACi0AAC4TwIAuE8CALhPAgAgJAIAICQCACAkAgBIGwYA

qdat:
AAAAAAAAAAACEAAAAAAAGAgKBAIAAAAwgFAiAIBAEoSCgEGQWCBMmXEQUG4IBFyDgFgtGZnWAgqlQ6DgCB9CHJN/icNUB47IdTQmOOn00Yc2KnenrGoJRl2J8J60pRGjCTKXDIB7rRDGweA2qMF/GTJqbkzrkEyAJ6NA1K==


formula: Ca3 Al2 H12 O12
compound: <missing>
pub_title: Neutron powder diffraction study of hydrogarnet to 9.0 GPa P = 0.78 GPa
formula_title: <missing>
a: 12.5130
b: 12.5130
c: 12.5130
alpha: 90
beta: 90
gamma: 90
cell_volume: 1959.225
crystal_density: 2.565
atoms_sites: ["Ca", "Al", "H", "O"]
atoms_x: IKEHAAAAAAAwWAkAoLgBAA==
atoms_y: AAAAAAAAAAAwogUAUDQDAA==
atoms_z: QEIPAICEHgDgbDAAgAMnAA==
atoms_occupancy: 0
atoms_u_iso: YG0AAGAJAAAgxQEAoIwAAA==
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:
AAAAAAAAAAAAAAAAAAAAEAACAAAAAAAIAEAAAEAIAgCAABAIAAACAgQABAgQIECAABAggggggBBACCEIAQhCEIQBAIRCEAiABCIiEQERAQAREQIAJAAIkBIAQAAgAABAAAAAAAAIgAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca3 Al2 H12 O12
compound: <missing>
pub_title: Neutron powder diffraction study of hydrogarnet to 9.0 GPa P = 3.6 GPa
formula_title: <missing>
a: 12.320
b: 12.320
c: 12.320
alpha: 90
beta: 90
gamma: 90
cell_volume: 1869.959
crystal_density: 2.687
atoms_sites: ["Ca", "Al", "H", "O"]
atoms_x: IKEHAAAAAABQWwkAUNYBAA==
atoms_y: AAAAAAAAAAAQVAUA0EADAA==
atoms_z: QEIPAICEHgCgfzAA4AwnAA==
atoms_occupancy: 0
atoms_u_iso: 4C4AAKCMAAAgQgIAAH0AAA==
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:
AAAAAAAAAAAAAAAAAAAABAAAgAAAAAABAAgAAAgBACAIAAEAgAAAICAgACBAQIECAAAgggQQQQAggAhBCAEIQhCEAQBEIRAEQAIRCIiAREBABERAQAiAARICQAgAAgAABAAAAAAAACQAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca3 Al2 H12 O12
compound: <missing>
pub_title: Neutron powder diffraction study of hydrogarnet to 9.0 GPa P = 6.1 GPa
formula_title: <missing>
a: 12.163
b: 12.163
c: 12.163
alpha: 90
beta: 90
gamma: 90
cell_volume: 1799.377
crystal_density: 2.793
atoms_sites: ["Ca", "Al", "H", "O"]
atoms_x: IKEHAAAAAADgdQkAIN4BAA==
atoms_y: AAAAAAAAAADADQUAYFsDAA==
atoms_z: QEIPAICEHgDwYTAA0BcnAA==
atoms_occupancy: 0
atoms_u_iso: kAEAAMBdAABAkAIAgD4AAA==
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:
AAAAAAAAAAAAAAAAAAAAAQAAIAAAAAAAQAEAAAEAIAQBAAAQCAAAAgEBAAICBAgIEAABBAggggQAggBBBCAEIQghCAIAiEIQCIACIRCIgERAQAIiQEAEQACIgSAEAAEAAACAAAAAAAAJAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca3 Al2 H12 O12
compound: <missing>
pub_title: Neutron powder diffraction study of hydrogarnet to 9.0 GPa P = 7.9 GPa
formula_title: <missing>
a: 12.077
b: 12.077
c: 12.077
alpha: 90
beta: 90
gamma: 90
cell_volume: 1761.478
crystal_density: 2.853
atoms_sites: ["Ca", "Al", "H", "O"]
atoms_x: IKEHAAAAAADApAkAIN4BAA==
atoms_y: AAAAAAAAAABAAQUAkGwDAA==
atoms_z: QEIPAICEHgBAdjAAkBEnAA==
atoms_occupancy: 0
atoms_u_iso: kAEAAIA4AQAgxQEAgD4AAA==
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:
AAAAAAAAAAAAAAAAAAAAAQAAEAAAAAAAEACAAABACAEAQAAEAgAAAEBAQABAgIECBAAAIIEEEECAEEAEIIIAghCEIIAgEIQhAIQAIRCIhARCAgAiIQIAIgAERAiAEAAIAAAEAAAAAAAAJAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca3 Al2 H12 O12
compound: <missing>
pub_title: Neutron powder diffraction study of hydrogarnet to 9.0 GPa P = 9.0 GPa
formula_title: <missing>
a: 12.024
b: 12.024
c: 12.024
alpha: 90
beta: 90
gamma: 90
cell_volume: 1738.389
crystal_density: 2.891
atoms_sites: ["Ca", "Al", "H", "O"]
atoms_x: IKEHAAAAAADg8gkAENABAA==
atoms_y: AAAAAAAAAABgTwUAcGkDAA==
atoms_z: QEIPAICEHgDghTAAQBYnAA==
atoms_occupancy: 0
atoms_u_iso: 0AcAAGDkAQBAlgEAIE4AAA==
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:
AAAAAAAAAAAAAAAAAAAAAIAACAAAAAAACABAAAAgBACAIAACAIAAACAgEAAgICBAgQAAECBBBBAgBAgBBCCAEIQQhCAIAhCIQBEABEIhEQCIgEAEREBABEAAiIEQAgAAgAAAQAAAAAAAAkAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Na2 Si4 O9
compound: <missing>
pub_title: Sodium tetrasilicate: A complex high-pressure framework silicate (Na6Si3[Si9O27])
formula_title: Na6Si3[Si9O27]
a: 10.875
b: 9.326
c: 19.224
alpha: 90
beta: 90.18
gamma: 90
cell_volume: 1949.693
crystal_density: 3.090
atoms_occupancy: 0
atoms_u_iso: 0
atoms_sites:
["Na1", "Na2", "Na3", "Na4", "Na5", "Na6", "Si1", "Si2", "Si3", "Si4", "Si5", "Si6", "Si7", "Si8", "Si9", "Si10", "Si11", "Si12", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "O20", "O21", "O22", "O23", "O24", "O25", "O26", "O27"]

atoms_x:

atoms_y:

atoms_z:

atoms_aniso_label:
["Na1", "Na2", "Na3", "Na4", "Na5", "Na6", "Si1", "Si2", "Si3", "Si4", "Si5", "Si6", "Si7", "Si8", "Si9", "Si10", "Si11", "Si12", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "O20", "O21", "O22", "O23", "O24", "O25", "O26", "O27"]

atoms_aniso_u11:

atoms_aniso_u22:

atoms_aniso_u33:

atoms_aniso_u12:

atoms_aniso_u13:

atoms_aniso_u23:

qdat:
AAAAAAAAACBAEAFDAAIJAB8xFgJDBeR8DBU9Tk3S9qSKe64/9+7VfX9/s/t/5//9x/9/969/v/9/f7//////1ev/f/+7//f/7/7/7f/////9/5/v//v3v//3/3/f/9d90zu37bdl+TdmyNtUlEKhtC0EhAIAgCAAAAAAAA==


