# cif

formula: Pb Ca2 Al F9
compound: Grand Reef mine, Aravaipa mining district, Arizona, USA
pub_title: The crystal structures and Raman spectra of aravaipaite and calcioaravaipaite
formula_title: <missing>
a: 5.3815
b: 5.3846
c: 12.2034
alpha: 91.364
beta: 101.110
gamma: 91.525
cell_volume: 346.720
crystal_density: 4.649
atoms_sites: ["Pb", "Ca1", "Ca2", "Al", "F1", "F2", "F3", "F4", "F5", "F6", "F7", "F8", "F9"]
atoms_x: 8J8QAEiSAgD4XxsAeHEMAJDDMwAwSC0AIJIWALCOAgAA9TcAwIoeANBcDwDwRg8A8KoPAA==
atoms_y: +DcRAChALgDY3CwAcJwMABD8AgAAmCEAkBoAABDDGABwuwYAMAkSAMB2AABQOx8AkIoXAA==
atoms_z: KIsGAJCBJQDAkRcAQPcxAHjcBQA4vBAA0NosAMjxNgAgCSwAEGM3AACWHgAA3B4AqMMRAA==
atoms_occupancy: 0
atoms_u_iso: MAYBAOCIAAA4iwAAMI4AAKBtAQDQAQEAUNwAAEAZAQAQCAEAIGEBAGC4AABAtQAAoPAAAA==
atoms_aniso_label: ["Pb", "Ca1", "Ca2", "Al", "F1", "F2", "F3", "F4", "F5", "F6", "F7", "F8", "F9"]
atoms_aniso_u11: MDgBAOCSAADAjwAAIJkAAFC9AQBQJwEAgO0AADBWAQDQtgAAwPMAAKC+AACAuwAAECEBAA==
atoms_aniso_u22: mBYBAKBzAABQeAAAwI8AAPA2AQCA1AAAUMMAAKAiAQAQCAEAkKoBACCZAADwoAAAoPAAAA==
atoms_aniso_u33: 2McAAHCUAACQlwAAsIEAABBsAQCwMAEAoPAAALDlAABgNQEAwFcBAIDUAAAgywAA4MQAAA==
atoms_aniso_u12: 0CUAAOgDAADI+///UPv//yADAADgLgAA4C4AAMBdAAAwEQAAsNL//8ASAADg/P//0Lz//w==
atoms_aniso_u13: WDkAALAdAAAAGQAAkBoAAAB9AADwhwAAUEYAAKBaAADw2P//QNT//4AlAABgOwAAsE8AAA==
atoms_aniso_u23: 6Pn//xgGAAAoCgAAYAkAADB1AADwbgAAsAQAANDu//9gvv//AM7//zARAADg/P//UMn//w==
qdat:
AAAAAAAACAAAAAAAAEAFAEAQAAMARABAAQAlAAAiUEIWRAoSIIAqEQgDECMOAXIaHXYBSmhKZcyhKRGeImZGXlPmPVW0WIbUlPge9Xvpu5eHg7gvoxS3n5v532RfcjVvuvI1/n1Ta18kb73a/tePW6b9r88/7Xvf37/59b==


formula: Ca2.354 Pb2.646 P3 O12 F
compound: Blue Bell claims, near Baker, San Bernardino County, California, USA
formula_title: <missing>
a: 9.6402
b: 9.6402
c: 7.0121
alpha: 90
beta: 90
gamma: 120
cell_volume: 564.353
crystal_density: 5.570
atoms_sites: ["Ca1", "Pb2", "Ca2", "P", "O1", "O2", "O3", "F"]
atoms_x: VVgUAMCfDgDAnw4A8IcZAIDsFQBw6CQAoAgWAAAAAAA=
atoms_y: q7AoAGiIAABoiAAAgK4XAGD+HgAw4BwAwPcQAAAAAAA=
atoms_z: 4EcAAEBCDwBAQg8AQEIPAEBCDwBAQg8AUHkEAICEHgA=
atoms_occupancy: AAk9AEDVNQDAMwcAAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: 0IQAAGC4AABguAAAsJoAAAD6AAAA+gAAwCUBAKB6AwA=
atoms_aniso_label: ["Ca1", "Pb2", "Ca2", "P", "O1", "O2", "O3", "F"]
atoms_aniso_u11: UJEAALCaAACwmgAA0J0AAIA4AQDgqwAAIMUBAADuAgA=
atoms_aniso_u22: UJEAAOCSAADgkgAAwHYAAMDaAAAA+gAAAPoAAADuAgA=
atoms_aniso_u33: QGoAANDoAADQ6AAAgLsAAAD6AAAAdwEAoAkBAICjBAA=
atoms_aniso_u12: cEkAAGA7AABgOwAAMEMAAOCrAABgbQAAwNoAAAB3AQA=
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAoJL//wAAAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA4LH//wAAAAA=
pub_title:
 Fluorphosphohedyphane, Ca2Pb3(PO4)3F, the first apatite supergroup mineral
 with essential Pb and F

qdat:
AAAAAAAAAAAAEAAAAAAEACAAAgIAARAAIQAAIiAgEAAECQkCgBQIKASBCEMKAgKGFQJIoFGGBBAqpjpRgixjAALNcs0D1iSVRVkerGaBjs1WabJ8nbm0xuzuUnidvuM7RkK5Wy9u+RImX5V9em2HKPNNvt1umkbn1FjpvL==


formula: Mn1.854 Fe1.656 Mg.537 Si.953 O9 H4
compound: N'chwaning 2 mine, Kalahari manganese field, South Africa
pub_title: Guidottiite, the Mn-analogue of cronstedtite: A new serpentine-group mineral from South Africa
formula_title: <missing>
a: 5.5472
b: 5.5472
c: 14.296
alpha: 90
beta: 90
gamma: 120
cell_volume: 380.972
crystal_density: 3.332
atoms_sites: ["MnM1", "Fe3+M1", "MgM1", "SiT1", "Fe3+T1", "SiT2", "Fe3+T2", "O1", "O4", "O5", "O-H1", "O-H2"]
atoms_x: 4LUoAOC1KADgtSgAAAAAAAAAAABVWBQAVVgUAGCoCwAAAAAAVVgUAKuwKABgchQA
atoms_y: gPP//4Dz//+A8///AAAAAAAAAACrsCgAq7AoAIBDFAAAAAAAq7AoAFVYFACgDwAA
atoms_z: 8H4OAPB+DgDwfg4A4FQCAOBUAgDgOwIA4DsCAAAAAAAglQkAEKAJAIC3CQAQzhIA
atoms_occupancy: QLglAOBjDADg7AoAQKcTAMBhKQBggyYAoIUWAAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: MNkAADDZAAAw2QAAoIwAAKCMAABwlAAAcJQAAOAoAQCwaAAAEHIAAEBRAADwhwAA
atoms_aniso_label: ["MnM1", "Fe3+M1", "MgM1", "SiT1", "Fe3+T1", "SiT2", "Fe3+T2", "O4", "O5", "O-H1", "O-H2"]
atoms_aniso_u11: oNcAAKDXAACg1wAAYIYAAGCGAACAiQAAgIkAAACWAACgcwAAQGoAAECcAAA=
atoms_aniso_u22: oNcAAKDXAACg1wAAYIYAAGCGAACAiQAAgIkAAACWAACgcwAAQGoAACDLAAA=
atoms_aniso_u33: UNwAAFDcAABQ3AAAkJcAAJCXAADgqwAA4KsAAKAPAABgbQAAQB8AAEAfAAA=
atoms_aniso_u12: YG0AAGBtAABgbQAAMEMAADBDAADARAAAwEQAAABLAADQOQAAIDUAACBOAAA=
atoms_aniso_u13: kAEAAJABAACQAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAfAAA=
atoms_aniso_u23: sAQAALAEAACwBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAKAPAAA=
qdat:
AAAAAAAAAAAAAACAAAAAABAgAAIAAIAgAAAAEBEAEACCwAgBBgAAGAACAiyEADECCIAoIGACEwAFlQHggiUBgQCdIBgIgRCsQGwJYxKASwIEg4gSJJQvIkAikuINBARMAYBLDEpBqlwSAhQ6CkgEwDA/CJUIBdDFCkgIHY==


formula: (Ca2.88 La.09 Mn.03) (Zr1.46 Nb.44 Mg.1) (Fe1.32 Al.84 Si.75 Ti.09) O12
compound: Kerimasi volcano, Tanzania
formula_title: <missing>
a: 12.5512
b: 12.5512
c: 12.5512
alpha: 90
beta: 90
gamma: 90
cell_volume: 1977.224
crystal_density: 4.164
atoms_sites: ["CaX", "LaX", "MnX", "ZrY", "NbY", "MgY", "FeZ", "AlZ", "SiZ", "TiZ", "O"]
atoms_x: IKEHACChBwAgoQcAAAAAAAAAAAAAAAAAYOMWAGDjFgBg4xYAYOMWAKADAgA=
atoms_y: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAFAbAwA=
atoms_z: QEIPAEBCDwBAQg8AAAAAAAAAAAAAAAAAQEIPAEBCDwBAQg8AQEIPAPDJJwA=
atoms_occupancy: AJg6AMDUAQBAnAAAQI4sAIBtDQBADQMAANsaAAAXEQBAQg8AwNQBAAAJPQA=
atoms_u_iso: AEsAAABLAAAASwAAUJEAAFCRAABQkQAAIMsAACDLAAAgywAAIMsAAEC1AAA=
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:
 Kerimasite, Ca3Zr2(Fe3+2Si)O12, a new garnet from carbonatites of Kerimasi volcano
 and surrounding explosion craters, northern Tanzania

qdat:
AAAAAAAAAAAAAAAAAAAAEAACAAAAAAAQAIAAAIAQBAEAACAQAAAEBAgAEBAgQIEAACCBBBBCACCAEIIQAhCEQRAEAhCIQCIAEIiIRAREBABERAgBEAAiQIgCAACAAAEAAAAAAAAkAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: As8 Fe2.032 Mg10.968 Ca4.362 Na1.218 Li1.42 O24 F14
compound: Nanling area, Hunan Province, China
pub_title: Crystal structure of nanlingite - the first mineral with a [Fe(AsO3)6] configuration
formula_title: <missing>
a: 10.2114
b: 10.2114
c: 25.689
alpha: 90
beta: 90
gamma: 120
cell_volume: 2319.789
crystal_density: 3.956
atoms_x: AAAAAOhaDQAAAAAAeC03AHgtNwCAtycAgLcnAFgXNgBYFzYAsG81AAAAAAAAAAAA2NsZAEgMKQAIkTQAAAAAABh6DgDI2xAA
atoms_y: AAAAABiuLwAAAAAAqJYbAKiWGwAAAAAAAAAAAKjxBgCo8QYAUJkHAAAAAAAAAAAAsLczAEi+AwD4dwgAAAAAAOiOLgD4bQgA
atoms_z: +M8UAPgeBwCAhB4AWDMGAFgzBgAAAAAAAAAAAFD5BgBQ+QYAAKoFAAAAAAAAAAAAUJP+/2A7+/+Qg/b/GCQFANi2+P/ASAEA
atoms_occupancy: AAk9AAAJPQAACT0AwKIzAEBmCQDA7zsAQBkBAGBfLABADQMAYJwNAMAHOABAAQUAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 6FgAAPBaAAAgWAAAcIoAAHCKAABQeAAAUHgAANAkAQDQJAEA0CQBAIDtAACA7QAAyHMAAIiVAADw0gAAoAMCACAvAQAouQAA
atoms_aniso_u11: 6FgAALBZAACYXQAAAJYAAACWAABwewAAcHsAAIAQAQCAEAEAgBABAIAfAQCAHwEAAH0AAACWAABAAAEA4FQCAODdAAAw8gAA
atoms_aniso_u22: 6FgAALBZAACYXQAAcJQAAHCUAABAagAAQGoAAIAQAQCAEAEAgBABAIAfAQCAHwEA4GAAAGCGAABAAAEA4FQCAODdAABQkQAA
atoms_aniso_u33: 6FgAACBTAABYTQAAMHUAADB1AACQfgAAkH4AAFBZAQBQWQEAUFkBAPCHAADwhwAAoHMAAFB4AABwlAAAIGEBAJAtAQAAyAAA
atoms_aniso_u12: YCwAADAlAADgLgAAKEsAAChLAADQNAAA0DQAAACRAAAAkQAAAJEAAMCPAADAjwAAcDAAABAnAABwlAAAcCoBABD1//9QeAAA
atoms_aniso_u13: AAAAAFD7//8AAAAAgNr//4Da///gAQAA4AEAAJDP//+Qz///kM///wAAAAAAAAAAoAUAAPAKAADgLgAAAAAAAFAtAABABgAA
atoms_aniso_u23: AAAAALAEAAAAAAAAQO3//0Dt///oAwAA6AMAAHAwAABwMAAAcDAAAAAAAAAAAAAA8AoAAFAtAAAg0f//AAAAALDS//8gAwAA
atoms_sites:
["As(1)", "As(2)", "Fe", "Mg(1)", "Fe(1)", "Mg(2)", "Fe(2)", "Ca", "Na", "Li", "Na", "Li", "O(1)", "O(2)", "O(3)", "F(1)", "F(2)", "F(3)"]

atoms_aniso_label:
["As(1)", "As(2)", "Fe", "Mg(1)", "Fe(1)", "Mg(2)", "Fe(2)", "Ca", "Na", "Li", "Na", "Li", "O(1)", "O(2)", "O(3)", "F(1)", "F(2)", "F(3)"]

qdat:
AAAAAAAAAAAAUAIAAAAAUAAFkgAABABSoACMCsAAIgtUASAdgAQtQCYuAEAtAkHQCH0FBgCj0FjwAHgooAmoUPBDApwIPBjgT4ogR0McEcMYM4QoDoVAHlGE0ZBnGOJxuE4BROFhHMgHKQEKYmFDcTAQIAxIHEgQgBAAmJ==


formula: U S2 O12 H8
compound: Synthetic
pub_title: The crystal structure of U(SO4)2*4H2O
formula_title: <missing>
a: 14.674
b: 11.093
c: 5.688
alpha: 90
beta: 90
gamma: 90
cell_volume: 925.885
crystal_density: 3.603
atoms_sites: ["U", "S", "O1", "O2", "O3", "O4", "Wat5", "Wat6", "Wat7"]
atoms_x: 4G8KAGBsFQDAehAAQCQUAABqGAAAahgAAHECAIBPEgAA4gQA
atoms_y: QEIPAMBLAwAAUwcAACc4AADiBAAA4gQAQEIPAEBCDwAAUwcA
atoms_z: oGIHAGCmNQBAUjYAALY1AEB+BQCASCgAQJUWAECVFgAAtjUA
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
qdat:
AAAAAAAAAAAAAAIAAQBCCBAKAQAIUBgCAB0IDFDE6YnDYAH8CYLYSYmym5cU6U1eBrtNer17qr+v/qi+7zv27Wbd2vzs9/v8/7W2/dvvtesPvu/t/t/rv2/v8zu9+v19VXvt773vzavuV9VT597bvf73yOfv2t3R63fWnf==


formula: (Zn.968 Fe.023 Cu.005 In.002 Cd.002) S
compound: Iwodake volcano, Satsuma-Iwojima, Kyushu, SW Japan
formula_title: <missing>
a: 5.4159
b: 5.4159
c: 5.4159
alpha: 90
beta: 90
gamma: 90
cell_volume: 158.859
crystal_density: 4.073
atoms_sites: ["Zn", "Fe", "Cu", "In", "Cd", "S"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAABAQg8A
atoms_y: AAAAAAAAAAAAAAAAAAAAAAAAAABAQg8A
atoms_z: AAAAAAAAAAAAAAAAAAAAAAAAAABAQg8A
atoms_occupancy: ABU7AGBnAQAgTgAAQB8AAEAfAAAACT0A
atoms_u_iso: AK8AAACvAAAArwAAAK8AAACvAACwgQAA
atoms_aniso_label: ["Zn", "Fe", "Cu", "In", "Cd", "S"]
atoms_aniso_u11: AK8AAACvAAAArwAAAK8AAACvAACwgQAA
atoms_aniso_u22: AK8AAACvAAAArwAAAK8AAACvAACwgQAA
atoms_aniso_u33: AK8AAACvAAAArwAAAK8AAACvAACwgQAA
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
pub_title:
 Crystal chemistry of ZnS minerals formed as high-temperature volcanic sublimates:
 matraite identical with sphalerite

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAACAAAAAAAAAAAAAAACAAAAAAAAAQAAgAAAAAAAAAIAAAAAAIAEAAAAAAACAAAAAEAAAAAAAAIAAAAIAgAAAAAIAAABAIAAAAAgAAAgEAAAACAAAEAAAAACAAAIEAAAAgA==


formula: Mg S O8 H8
compound: Calingasta, San Juan Province, Argentina
pub_title: Cranswickite MgSO4*4H2O, a new mineral from Calingasta, Argentina
formula_title: <missing>
a: 11.9236
b: 5.1736
c: 12.1958
alpha: 90
beta: 117.548
gamma: 90
cell_volume: 667.037
crystal_density: 1.916
atoms_sites: ["Mg", "S", "O1", "O2", "Wat3", "Wat4"]
atoms_x: AAAAAAAAAABQHAcAoAU8APB1NQBwJDQA
atoms_y: AAAAADAcEwCAfh8AALEIAGBMKwAwUw4A
atoms_z: gIQeAMDGLQBQ2hEAgGcnAABfHgBAxxYA
atoms_occupancy: 0
atoms_u_iso: eOsAAKA2AQCgnwEAKMcBAPi7AABISQAA
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:
AAAAAAAAAAAAAAAAAAAJAAEAAAIAAAAAEEAAgACCWCAABQBAiBAkEEQAiEYEEEQwQVEkAE1ksAgSQkJwEuCIWiwWqhRYUNJCxyESXGntIny/ILKvi4NkT28pa3roTK53l0Kr2Y32xEzkloj0ppoLlXZtyoI5zWKZqo95nK==


formula: (Mg.77 Cr.23) O2.966 H3.224 C.118
compound: Tasmania, Australia
formula_title: <missing>
a: 3.09552
b: 3.09552
c: 23.5042
alpha: 90
beta: 90
gamma: 120
cell_volume: 195.049
crystal_density: 2.115
atoms_sites: ["Mg", "Cr", "O1", "H1", "Wat2", "CO3", "O3"]
atoms_x: AAAAAAAAAABVWBQAVVgUAKCUBwBVWBQAVVgUAA==
atoms_y: AAAAAAAAAACrsCgAq7AoAGBr+P+rsCgAq7AoAA==
atoms_z: AAAAAAAAAAAgvxYAIBcZAICEHgCAhB4AgIQeAA==
atoms_occupancy: QP8uAMAJDgAACT0AAAk9AMA5BgDgmQMAoM0KAA==
atoms_u_iso: uB8AALgfAAD4BwAA+AcAAOgDAADoAwAA6AMAAA==
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 crystal structure of stichtite, re-examination of barbertonite, and the
 nature of polytypism in MgCr hydrotalcites
 Note: 3R1 polytype of stichtite

qdat:
AAAAAAAAAAAAAIAAAAAAAAAAAACAAAAAAAAAAAAIwAAgAgAAAAgABAAAAAAQAAAAAAACAgAACAAAAAKAQQAAQBAAABAAAAAAAAAAAAAGBCAAgIAAEAAAAQgAQAABAAAAAAAAAAAIgBAABQkAIIABAAAAAAAAUJAIIAEAAA==


formula: (Mg.75 Cr.25) O2.984 H3.224 C.124
compound: Barberton, South Africa
formula_title: <missing>
a: 3.09689
b: 3.09689
c: 15.6193
alpha: 90
beta: 90
gamma: 120
cell_volume: 129.731
crystal_density: 2.143
atoms_sites: ["Mg", "Cr", "O1", "H1", "Wat2", "CO3", "O3"]
atoms_x: AAAAAAAAAABVWBQAVVgUAMAJDgBVWBQAVVgUAA==
atoms_y: AAAAAAAAAACrsCgAq7AoAED28f+rsCgAq7AoAA==
atoms_z: AAAAAAAAAACg9wMA4P4HAEBCDwBAQg8AQEIPAA==
atoms_occupancy: wMYtAEBCDwAACT0AAAk9AIBzDACAkQcAgLQWAA==
atoms_u_iso: SJ4AAEieAAC4fgAAuH4AALh+AAC4fgAAuH4AAA==
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 crystal structure of stichtite, re-examination of barbertonite, and the
 nature of polytypism in MgCr hydrotalcites
 Note: Sample 84588, 2H1 polytype of stichtite = barbertonite

qdat:
AAAAAAAAAAAAAIAAAAAAAAAAAABAAAAAAAAAAAAiQIABAAAIAAAEACAAgAAAAgAAAAIiAgABCAAAACqQCAEAAgIBAAAgAACQAACAAAAsQICACABAAEAAIZBCQBARAAQABAABAAAogBAABYQICEIAEADAAQAA5EEBAIAgAQ==


formula: (Mg.81 Cr.19) O2.903 H3.224 C.097
compound: Barberton, South Africa
formula_title: <missing>
a: 3.09646
b: 3.09646
c: 15.627
alpha: 90
beta: 90
gamma: 120
cell_volume: 129.759
crystal_density: 2.058
atoms_sites: ["Mg", "Cr", "O1", "H1", "Wat2", "CO3", "O3"]
atoms_x: AAAAAAAAAABVWBQAVVgUAMAJDgBVWBQAVVgUAA==
atoms_y: AAAAAAAAAACrsCgAq7AoAED28f+rsCgAq7AoAA==
atoms_z: AAAAAAAAAABQmAMAoJL//0BCDwBAQg8AQEIPAA==
atoms_occupancy: QHAxAMCYCwAACT0AAAk9AIBzDACg6wUA4MIRAA==
atoms_u_iso: oEABAKBAAQBoUAEAaFABAGhQAQBoUAEAaFABAA==
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 crystal structure of stichtite, re-examination of barbertonite, and the
 nature of polytypism in MgCr hydrotalcites
 Note: Sample 92459, 2H1 polytype of stichtite = barbertonite

qdat:
AAAAAAAAAAAAAIAAAAAAAAAAAABAAAAAAAAAAAAiQIABAAAIAAAEACAAgAAAAgAAAAIiAgABBAAAAEaQCAEAAgIBAAAgAACQAACAAAAsQIBACABAAEAAIZBCQBARAAQABAABAAAogBAAB4QIBEEAEADAAQAA5EEBAIAQAQ==


formula: (Mg.75 Cr.25) O2.984 H3.224 C.124
compound: Barberton, South Africa
formula_title: <missing>
a: 3.09689
b: 3.09689
c: 15.6193
alpha: 90
beta: 90
gamma: 120
cell_volume: 129.731
crystal_density: 2.143
atoms_sites: ["Mg", "Cr", "O1", "H1", "Wat2", "CO3", "O3"]
atoms_x: AAAAAAAAAABVWBQAVVgUAMAJDgBVWBQAVVgUAA==
atoms_y: AAAAAAAAAACrsCgAq7AoAED28f+rsCgAq7AoAA==
atoms_z: AAAAAAAAAACg9wMA4P4HAEBCDwBAQg8AQEIPAA==
atoms_occupancy: wMYtAEBCDwAACT0AAAk9AIBzDACAkQcAgLQWAA==
atoms_u_iso: SJ4AAEieAAC4fgAAuH4AALh+AAC4fgAAuH4AAA==
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 crystal structure of stichtite, re-examination of barbertonite, and the
 nature of polytypism in MgCr hydrotalcites
 Note: Sample 84588, 2H1 polytype of stichtite

qdat:
AAAAAAAAAAAAAIAAAAAAAAAAAABAAAAAAAAAAAAiQIABAAAIAAAEACAAgAAAAgAAAAIiAgABCAAAACqQCAEAAgIBAAAgAACQAACAAAAsQICACABAAEAAIZBCQBARAAQABAABAAAogBAABYQICEIAEADAAQAA5EEBAIAgAQ==


formula: (Mg.81 Cr.19) O2.903 H3.224 C.097
compound: Barberton, South Africa
formula_title: <missing>
a: 3.09646
b: 3.09646
c: 15.627
alpha: 90
beta: 90
gamma: 120
cell_volume: 129.759
crystal_density: 2.058
atoms_sites: ["Mg", "Cr", "O1", "H1", "Wat2", "CO3", "O3"]
atoms_x: AAAAAAAAAABVWBQAVVgUAMAJDgBVWBQAVVgUAA==
atoms_y: AAAAAAAAAACrsCgAq7AoAED28f+rsCgAq7AoAA==
atoms_z: AAAAAAAAAABQmAMAoJL//0BCDwBAQg8AQEIPAA==
atoms_occupancy: QHAxAMCYCwAACT0AAAk9AIBzDACg6wUA4MIRAA==
atoms_u_iso: oEABAKBAAQBoUAEAaFABAGhQAQBoUAEAaFABAA==
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 crystal structure of stichtite, re-examination of barbertonite, and the
 nature of polytypism in MgCr hydrotalcites
 Note: Sample 92459, 2H1 polytype of stichtite

qdat:
AAAAAAAAAAAAAIAAAAAAAAAAAABAAAAAAAAAAAAiQIABAAAIAAAEACAAgAAAAgAAAAIiAgABBAAAAEaQCAEAAgIBAAAgAACQAACAAAAsQIBACABAAEAAIZBCQBARAAQABAABAAAogBAAB4QIBEEAEADAAQAA5EEBAIAQAQ==


formula: Cu Cr2 S4
compound: <missing>
formula_title: <missing>
a: 9.82
b: 9.82
c: 9.82
alpha: 90
beta: 90
gamma: 90
cell_volume: 946.966
crystal_density: 4.150
atoms_sites: ["Cu", "Cr", "S"]
atoms_x: AAAAAKAlJgCgfxcA
atoms_y: AAAAAKAlJgCgfxcA
atoms_z: AAAAAKAlJgCgfxcA
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:
 Spinelle mit substituierten Nichtmetallteilgittern. IV. Roentgenographische
 Untersuchung der Systeme CuCr2(S11-xSex)4 und CuCr3(Se1-xTex)4

qdat:
AAAAAAAAAACAAAAgAAEAAIABAAQAAAQAgCAIAgEBAACAgQECBAgAQIIIAEIAIIQQhCAEIQhEIBCIRCIBERAIgIiIiQEiIkQIkSJAiRBIEiSSCRJJAJJJBJISCSkkJKSgpISFKAgKSoIlSAqVAhChEChQIgQiBgABIiABAA==


formula: Ca2 Ba Si3 O9
compound: Esquire No. 8 claim, Big Creek, Fresno County, California, U.S.A.
formula_title: <missing>
a: 6.7335
b: 9.6142
c: 6.6859
alpha: 69.638
beta: 102.281
gamma: 96.855
cell_volume: 396.009
crystal_density: 3.738
atoms_sites: ["Ca1", "Ca2", "Ba1", "Si1", "Si2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9"]
atoms_x: 4NIQAMCsGgAQ4wIAiOUFAMhHDgAA7xoAuD4OAHDX+f+YyQIAgMMWAHA8CACQ9RUAAHslAPgBHwDwEA4A
atoms_y: sBcfABCLMgAozDMAoI4NAPBgHQDw+QsAAPAPAEh+BwCAqhYAMPQhAGjEIwBouRUAIEoOAGiXBQAomQcA
atoms_z: QJEuABikOQD4nhMASE8JABh3EQCgVB8AkDX+//BZBgCAPAwAcIkGAJCQFgDI4R4AEH8WAIAzLgDo/xcA
atoms_occupancy: 0
atoms_u_iso: 6LcAAAiYAACgvgAAYIYAAJCIAABYiQAA6LcAAOi3AABItwAAULQAAOjkAADYvQAAmLIAABjJAAAIpwAA
atoms_aniso_label: ["Ca1", "Ca2", "Ba1", "Si1", "Si2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9"]
atoms_aniso_u11: gM8AAHiHAAA41gAA0H8AAOCDAABYhAAAUKoAANiaAADIpQAAyK8AAMgdAQAo6wAA8K8AAFD/AAAwpwAA
atoms_aniso_u22: uKYAAHi0AAAYqwAAuIgAALiSAADImwAAgMUAANizAAAAtAAAAMgAAFC5AAD4ogAAINAAAPi7AAD4nQAA
atoms_aniso_u33: sKkAANikAAAAwwAAUJEAAECXAAD4egAA+MAAAFDXAAA4zAAAoKUAACD4AACgrwAAUK8AABiXAACApwAA
atoms_aniso_u12: 0AcAAHANAACQHwAAmPn//9gOAACYCAAAQAEAAJj5///gFQAAYOb//3AmAABQFAAA6O///0gcAACgBQAA
atoms_aniso_u13: SD8AALAxAADgJAAAuDMAAJA4AABgIgAAOFQAANAlAAB4MgAAgE0AAIhjAADgLgAAEFQAAAAoAAAwJQAA
atoms_aniso_u23: AOL//2i2//94v///aNT//6DJ///g2f//8M7//5i9///Yzf//ONL//xi2//+Ay///ELn//7jZ//+w1///
pub_title:
 Structure of walstromite, BaCa2Si3O9, and its relationship
 to CaSiO3-walstromite and wollastonite-II

qdat:
AAAAAAAAAAACAAAAgwAAQAAJAJAABAAhgI1AAADpZAAhACEDMJisBCxBV6RAEpQ+Vo2C9ttEqMSQy8+DfXQKU9c9fo5e7ta2/kTf7/z/3jr+sNq1PP/bf737L3d3fv7kvzqq3934/btp/8/rL/3eveJ+/t/6/f25Nv/v3/==


formula: Cu4 U Mo2 (O16 H6)
compound: Synthetic
pub_title: Crystal structure of Cu4UO2(MoO4)2(OH)6
formula_title: <missing>
a: 19.8392
b: 5.5108
c: 6.1009
alpha: 90
beta: 90
gamma: 104.477
cell_volume: 645.832
crystal_density: 4.865
atoms_sites: ["Cu1", "Cu2", "U", "Mo", "O-H1", "O2", "O-H3", "O4", "O5", "O6"]
atoms_x: 2DsPAEBCDwAAAAAAUJYZAIBzDAAgCgMAcFoSANAhBACwexoAIAgUAA==
atoms_y: YMweAAAAAAAAAAAAkCsSABCJEQBAEhcAEE8KAMB0EQDQ6ggAQEIPAA==
atoms_z: AAAAAEBCDwAAAAAAAAAAAPD7DgCAhB4AgIQeAAAAAADANQ8AAAAAAA==
atoms_occupancy: 0
atoms_u_iso: WJgAAHCUAACwhgAAmIoAAFiiAADgKAEAWKIAAOAoAQAgEQEAcOkAAA==
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:
AAAAAAAAAABAAAAAAQAAIDAAAAADEAAACIIAgoAICQBKCAFkAESEaAEVgwJGUgBCGkGdCFBIhEqgjiWWIZRKCnGWNIFFYbMgaBHjKWA2L6RGwmUPQVI1MDjpa3yEUj0TUnikghMYPJZnQUP8w2nHqImH0EFq4l7pun4LCX==


formula: K Na Mg2 P2 O22 H28
compound: Mono Lake, California, USA
formula_title: <missing>
a: 6.9349
b: 25.1737
c: 11.2195
alpha: 90
beta: 90
gamma: 90
cell_volume: 1958.668
crystal_density: 1.875
atoms_occupancy: 0
pub_title:
 Hazenite, KNaMg2(PO4)2*14H2O, a new biologically related phosphate mineral,
 from Mono Lake, California, U.S.A.

atoms_sites:
["K", "Na", "Mg1", "Mg2", "P1", "P2", "O1", "O2", "O3", "O4", "O5", "O6", "OW7", "OW8", "OW9", "OW10", "OW11", "OW12", "OW13", "OW14", "OW15", "H11", "H21", "H31", "H32", "H41", "H42", "H51", "H52", "H61", "H62", "H71", "H81", "H82", "H91", "H92"]

atoms_x:
wMYtAMDGLQDAxi0AwMYtAEBCDwDAxi0AQEIPAEBCDwBQWRoAwMYtAMDGLQCw2jgAwMYtAMDGLQDQpSAAoHU6AHC1IADg+DoAwMYtAMDGLQBAnAAAoFQzAEDhMwDAtRsAIIIhAKB6AwBg+TwAQHcbAGCzHgCAXzkA4BwDAGCyMwDAxi0AwMYtAKB6AwBAOjoA

atoms_y:
gIYNAEAGAADwPjoAUKcNAJDRBwCAwwcA4EkIAEAoCwAA9QUAkBsEAEBsCABwRQkAcJQAAACXNgAQ6jcAMLY8AFA3DwDg/wsAIHwJAHAoEgDQpAMAQJYBAGCmNQAAsDYAIHs3AKChOwBgZwEAwAkOAMD3EAAgDAsA4OwKAGA9CABg9RMAoJ0SAADiBACAowQA

atoms_z:
YJoeADCDOABA/SYA4A8zALAPLAAQbw0AgGQ0AABVKAAw3SkAEN8LAKCkFQDg8gkAwO4eAOB4LgBgPSEAcAMtAHAiLACQ6jkAEJYsAIB+OABw9DsAgIodAMA3MACA6SIA4IAcAMBDLgDgICwA4CYrAECUKwCgCQEAoDY4AEARLABAUjYA4C4AAEC9OQBgYQIA

atoms_u_iso:
kHICACApAgAw8gAAEAgBAKDXAACwzAAAgJwBAJB4AQBwXAEAgIMBABBTAQDQTAEA0OIBADA3AgBwjgEAQH0BAEDhAQCAnAEAANsBANB4AgCAGQIAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoA

atoms_aniso_label:
["K", "Na", "Mg1", "Mg2", "P1", "P2", "O1", "O2", "O3", "O4", "O5", "O6", "OW7", "OW8", "OW9", "OW10", "OW11", "OW12", "OW13", "OW14", "OW15"]

atoms_aniso_u11:
8EMDAACpAQDA2gAAECEBAHDfAACQsAAAAJABAHDAAQCAHwEA0GUBAHBcAQDA8wAAYE4BAKDXAADAVwEAAEUBAFDWAQAQtwEAMD0BAACwBABAdwIA

atoms_aniso_u22:
IMUBANB4AgDQ6AAAoPAAAHDGAACQyQAA8OUBAHD4AACgVAEAUPUAACCTAQAAkAEAcNkBAICvAgBQCAIAACwBAEBLAQAQ0AEA0GUBAAATAQBQ1gEA

atoms_aniso_u33:
gEsCAABYAgBwEQEAEAgBAJDiAACA7QAAkF8BANCwAQAwoQEA0C0CAMAMAQCwYgEAoIACAOAcAwCwSQEAUAgCAMCDAgDwTwEAcOwCAOClAQBg/QEA

atoms_aniso_u12:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAADAEgAAAAAAAAAAAAAw3///AAAAAAAAAAAgbf//cOX//yADAACAPgAAAAAAAAAAAAAgAwAA

atoms_aniso_u13:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACg9v//AAAAAAAAAACgKAAAAAAAAAAAAACAJQAAcLP//zBJ//9gCQAAAAAAAAAAAACQfgAA

atoms_aniso_u23:
AGr//zCOAABgIgAAQAYAAJABAADwIwAAAM7//5AzAACg9v//0NX//5ABAABwSQAA4A8BANDJAQAA5///0AcAALBPAABgOwAA4E3//2C+//9Qyf//

qdat:
AAAAAAAAIAQAAAACCBSCECBAooAoIQWbjI3HGL0QN+w6E7/p6ynbc9Sjyx3dv6bfd932+rw/39r6/73++3d4///9T7f+//v//v//+X/t3t3f2+6f969X2vWy71/f/bnv7X/zGeRs/bduZ9+/7xj/kTj///2v/369uvI6n5==


formula: Ca As2 O8 H4
compound: Synthetic
pub_title: The crystal structure of calcium dihydrogen arsenate, Ca(H2AsO4)2
formula_title: <missing>
a: 8.558
b: 7.697
c: 5.721
alpha: 92.583
beta: 109.867
gamma: 109.983
cell_volume: 327.494
crystal_density: 3.265
atoms_sites: ["Ca1", "As1", "As2", "O1", "O-H2", "O-H3", "O4", "O-H5", "O6", "O-H7", "O8"]
atoms_x: OPoEANDZFABAaQsAcKMKANATFwDwdiAAEOcSABDjAgBApAcAkHQKAFAzGAA=
atoms_y: aF8LAGiiDgBwxS4AQLwDAFB+GAAAsgwAEMgTAMD9KABgTzcA8JwiAHCINAA=
atoms_z: 6AQTAMgQ//8AMhQAUC0AALBfDgDwoQQAANDu/zAFAgBwGB0A8I4cAGCLFAA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Ca1", "As1", "As2", "O1", "O-H2", "O-H3", "O4", "O-H5", "O6", "O-H7", "O8"]
atoms_aniso_u11: WO0AAMjNAACw0QAAyM0AACipAQA4+QAA2CYBADBMAQDIiwEAKF4BAHjXAAA=
atoms_aniso_u22: YO8AAHjXAABo0wAAGAUBAJCHAQBQvQEASEgBACCoAADILAEAsDABAEhIAQA=
atoms_aniso_u33: OKQAAMjDAACI0QAAgNkAANgcAQBwigAA0MUAAOC/AABw6QAAoCwBAKA2AQA=
atoms_aniso_u12: kCkAAGgfAABgJwAAqBsAAPhSAABARwAAEDsAAGgfAACYbAAAEDsAALgBAAA=
atoms_aniso_u13: SCsAAEg1AABoMwAAaCkAALByAADQBwAAWCUAACD+//+gZAAAKDcAAGgzAAA=
atoms_aniso_u23: mCEAAHgjAACgGQAAaCkAAKAZAAAo9v//CEMAAIgdAACYIQAAEFkAACj2//8=
qdat:
AAAAAAAAAAAAAAiAAAABAAAAgACAYEAAAAABIQIEgAQASABJACASCkAAUCBMiCBKEEoBAMImGyKACQESyASSNEnB4KigHGiWydW4JBLwosw/ccMEWzk92vHzwNO9RubGtlg8/jRLdVt3f/iW027JMWLPnbdOWUv593nX9H==


formula: As2 Ca O8 H4
compound: Synthetic
formula_title: <missing>
a: 8.558
b: 7.697
c: 5.721
alpha: 92.35
beta: 109.52
gamma: 109.59
cell_volume: 329.621
crystal_density: 3.244
atoms_sites: ["As1", "As2", "Ca1", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "H1", "H2", "H3", "H4", "H5"]
atoms_x: CNkUAMBrCwBw+QQAUKAKABAaFwAQECEA0PkSAGDFAgDwqAcA0GEKALA8GACAniIAcOAdAJDTDwAAAAAAgIQeAA==
atoms_y: cKQOAEDILgCgYwsAEMQDAOB/GAAgtQwAQNkTAFDmKAAQVDcAgJ4iALB1NAAAvgoAcHAfABCUJACAhB4AAAAAAA==
atoms_z: YBn//4gxFADQEhMAADIAAAB0DgDgegQA8PPu/yDeAQDwCx0AEHkcAFDIFAAQRfv/MN0QAKDUJgAAAAAAgIQeAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["As1", "As2", "Ca1", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "H1", "H2", "H3", "H4", "H5"]
atoms_aniso_u11: WIQAAGCQAAD4BgEAiMcAANAQAQCw0QAAyAQBAChKAQDADAEAkDIBAOi3AABgRAEAeIsBAOA7AgA4wQEACAoCAA==
atoms_aniso_u22: 6KMAAECcAABQ4QAA6MEAAOgMAQDQZQEAoNcAAEiUAACo2QAAIPMAAGBEAQAQKgIAoDYBALj5AgDAUQIA2JgCAA==
atoms_aniso_u33: GKYAAOitAACQ3QAAaOcAADABAQCoLgEA0MUAAGDlAABQ/wAAGA8BAJBGAQDYLwIAkOYBAFCfAQAYbgEAIHkCAA==
atoms_aniso_u12: cCEAAEAzAAD4UgAAiBMAAKAjAABIgAAAaB8AABhHAADYcgAAoG4AAEAzAADotwAAaPL//5gqAQDgvwAACEwBAA==
atoms_aniso_u13: KEEAAFg5AAC4YAAAGFsAALByAADwUAAASD8AALgLAABYhAAAME0AAJB+AAD4sQAA+FwAAFAtAAAQTwAAgDgBAA==
atoms_aniso_u23: YCcAAMANAACYKwAAmCEAAKDi//8gPwAAQD0AAIgTAACQHwAAuGAAAEj0///AFwAAsMj//+DJAADwZAAAIAcBAA==
pub_title:
 A neutron diffraction study of the crystal structure of calcium
 bis(dihydrogen arsenate), Ca(H2AsO4)2

qdat:
AAAAAAAAAAAAAAiAAAACAAACAAEAgIAAAAAIhAgGAAgAoANEAIBQUgAAwgC4QgRIgzAICAtScOQAUBBdAVCjQzQyipYDhmzZarUIQj6p8g29aUCR1k7oud9QmW8xYvKriDo/+Ze4TH8t/qJ3vli77Xr7/bvyW+798+/plt==


formula: Mo2 Cu3 O10 H2
compound: Synthetic
formula_title: <missing>
a: 5.3867
b: 14.001
c: 5.6010
alpha: 90
beta: 98.535
gamma: 90
cell_volume: 417.745
crystal_density: 4.329
atoms_sites: ["Mo", "Cu1", "Cu2", "O1", "O2", "O3", "O4", "O-H5"]
atoms_x: SKsCAICEHgAwTwgAwKcVANBMAQDQNQkAwDIDAEAICAA=
atoms_y: gPMnAICEHgCATTcAIGolAPBnLwBw5RgA0JYWACDeAQA=
atoms_z: CAQmAICEHgCYTR8A4CsmAOBcIgDgmyQAYBcGAAD5FQA=
atoms_occupancy: 0
atoms_u_iso: gIkAAECcAADAqAAAkMkAAEAyAQCABgEA8OsAAJCwAAA=
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:
 Hydrothermal synthesis and thermal stability of natural mineral lindgrenite
 Note: atomic coordinates transformed to standard setting

qdat:
AAAAAAAAAAAAAAAgAAACIgAASAAAAJQABAAJBBEIiBoAhaCEWoIIAUYigQGvpgDycmSAofxSIqz2w4nko/OX9AO5i0cU25F6NSPfHTXnK65Zu5+P7K46i5z2nG7VY3Z7a6wtf8fv7Xvv1LsbNcfN/2r87Z6fb9zzxv/N81==


formula: Si O2
compound: Ellora Caves, India
pub_title: New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 0.2 GPa
formula_title: <missing>
a: 4.9501
b: 4.9501
c: 6.9259
alpha: 90
beta: 90
gamma: 90
cell_volume: 169.709
crystal_density: 2.352
atoms_sites: ["Si", "O"]
atoms_x: sHkSAECTDgA=
atoms_y: sHkSAOCgBgA=
atoms_z: AAAAABAXCwA=
atoms_occupancy: 0
atoms_u_iso: 0J0AAGDqAAA=
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAgAABAAAAAABAAAAAMAAgAIACgAAAAAQAABEAgAAUAkEAIAAFAAJCkABAgACQiQGRQAIQCFgIKIAgIAghRFygiAqEhUghECAxCOIRAjSlkmQBTMOZJIDI3gikBDIyaSCe7kxEEQPrWggd==


formula: Si O2
compound: Ellora Caves, India
pub_title: New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 0.6 GPa
formula_title: <missing>
a: 4.908
b: 4.908
c: 6.784
alpha: 90
beta: 90
gamma: 90
cell_volume: 163.416
crystal_density: 2.442
atoms_sites: ["Si", "O"]
atoms_x: MNESALCRDgA=
atoms_y: MNESABAWBwA=
atoms_z: AAAAABBiCwA=
atoms_occupancy: 0
atoms_u_iso: QBkBAOCrAAA=
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAIAAAQAAAAAAEAAAACQAIACAAQgAAAABAAAIBAgABAFCQAQAAQgAgkggBBAAIKAgJFEAQAmCoCIIAEAQIiFBlUgESFg4gQgKACVKqAawlGCKsBFSHIoVITS4MNEEFZnk5mtZLJECCWqFZ==


formula: Si O2
compound: Ellora Caves, India
pub_title: New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 3.6 GPa
formula_title: <missing>
a: 4.746
b: 4.746
c: 6.445
alpha: 90
beta: 90
gamma: 90
cell_volume: 145.171
crystal_density: 2.749
atoms_sites: ["Si", "O"]
atoms_x: 0METACBFDgA=
atoms_y: 0METAKBvCQA=
atoms_z: AAAAAIAoDAA=
atoms_occupancy: 0
atoms_u_iso: gLsAAECcAAA=
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAQAAAAAAAIAAAAQgAgAIAAgEAAAAAgAAIAAhAAQJICgBAAAgEEAUQAQQgAICQgMKAoCACQhAKRBAAQASYFECghARRBiAiQhBABmigEKOQYAyTkFoRQwiANhUEEaDINhROZ2Go4kF==


formula: Si O2
compound: Ellora Caves, India
pub_title: New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 5.4 GPa
formula_title: <missing>
a: 4.682
b: 4.682
c: 6.311
alpha: 90
beta: 90
gamma: 90
cell_volume: 138.344
crystal_density: 2.885
atoms_sites: ["Si", "O"]
atoms_x: QD0UABAFDgA=
atoms_y: QD0UAAAPCgA=
atoms_z: AAAAAPDuDAA=
atoms_occupancy: 0
atoms_u_iso: oIwAACBOAAA=
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAABAAACAAAAAAAAgAAACBACAAgACAEAAAAAgAAQAAIgAQGECEBAAAQAiAIUAAkQAEAiQCJgBggAkIoAFICAAgALASgTCAqAkC4AsgEAQApEiASSkUAUw5FQQoagICpkAKEJQFwog6RSqV==


formula: Si O2
compound: Ellora Caves, India
pub_title: New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 7.3 GPa
formula_title: <missing>
a: 4.632
b: 4.632
c: 6.209
alpha: 90
beta: 90
gamma: 90
cell_volume: 133.217
crystal_density: 2.996
atoms_sites: ["Si", "O"]
atoms_x: EHcUAEDkDQA=
atoms_y: EHcUAIDKCgA=
atoms_z: AAAAAECZDQA=
atoms_occupancy: 0
atoms_u_iso: YG0AAAB9AAA=
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAgAAAAAAACAAAAQEAIAEAAIAIAAAABAAAgAAFABAEIECBAAAgAUAIKAAMQAEAgwCDgAIQACECAB0AQAEABwIoEIgCQHBDABMBEAgDJCBCyGmUA0J01CFAiIIGCcAMECoRhJIokk==


formula: Si O2
compound: Ellora Caves, India
pub_title: New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 9.1 GPa
formula_title: <missing>
a: 4.599
b: 4.599
c: 6.130
alpha: 90
beta: 90
gamma: 90
cell_volume: 129.654
crystal_density: 3.078
atoms_sites: ["Si", "O"]
atoms_x: QLoUAOCoDQA=
atoms_y: QLoUAID8CgA=
atoms_z: AAAAAEA1DQA=
atoms_occupancy: 0
atoms_u_iso: wNoAAOCrAAA=
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAQAAAAAAAAgAAAEAgCABAACAAQAAAAIAAIAAAMAEApAgEIAACAAQBAYAAIgAgCBAEDAAIgBEIEgBkAIACABkQwINAAiCRBIBohAgIDpBACTEkJAKA0hiCgOIgjKFEEhAJIhhgUR==


formula: Si O2
compound: <missing>
formula_title: <missing>
a: 8.011
b: 4.544
c: 8.890
alpha: 90
beta: 121.0
gamma: 90
cell_volume: 277.391
crystal_density: 2.877
atoms_sites: ["Si1", "Si2", "O1", "O2", "O3", "O4"]
atoms_x: IEsmAEDbNACAwTEAAGIqAFBNHACAPwQA
atoms_y: 0D0QAFBZAQDwqAcA4LEYAGCZAQDA4wsA
atoms_z: UKQzANDgKwDQ+zMAsK0BAACJMABAaS4A
atoms_occupancy: 0
atoms_u_iso: QBkBAEAZAQCAtQEAgLUBAIC1AQCAtQEA
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:
 New insights into the high-pressure polymorphism of SiO2 cristobalite
 Note: P = 3.5 GPa, data transformed from Dove et al (2000)

qdat:
AAAAAAAAAAAAAAAIAAAAAAAAAABGAAEAAAQBACQAAAAAQCQQUAEQECAtAABGChAAYwCAaAFSFCIKUBD2EgXgADARKQJMUccEwmBSKldkxoTKI0umc0G46yk6NzpbzLBadDJXkXZIbbZ92vSfJ3z6NbZV3rcrwvrQq/rL2/==


formula: Si O2
compound: Ellora Caves, India
formula_title: <missing>
a: 8.011
b: 4.544
c: 8.890
alpha: 90
beta: 121.0
gamma: 90
cell_volume: 277.391
crystal_density: 2.877
atoms_sites: ["Si1", "Si2", "O1", "O2", "O3", "O4"]
atoms_x: ED0mANByNQDgfzEAQJoqAMBLHAAQDwQA
atoms_y: YLwQAHB7AAAg2QYA0AEaAGD9AQCAZgoA
atoms_z: gLUzACAOLADghjQAoAMCAKAVMQBQ+i0A
atoms_occupancy: 0
atoms_u_iso: 4KsAAMDaAABg6gAA4CgBAOCrAAAA+gAA
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:
 New insights into the high-pressure polymorphism of SiO2 cristobalite
 Note: P = 4.9 GPa
 Note z-coordinate of O2 is corrected

qdat:
AAAAAAAAAAAAAAAIAAAAAAAAAABGAAEAAAQBACQAAAAAQCQQUAEQECAtAABGChAAYwCAaAFSFCIKUBD2EgXgADARKQJMUccEwmBSKldkxoTKI0umc0G46yk6NzpbzLBadDJXkXZIbbZ92vSfJ3z6NbZV3rcrwvqYq/rL2/==


formula: Si O2
compound: Ellora Caves, India
pub_title: New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 7.4 GPa
formula_title: <missing>
a: 7.894
b: 4.456
c: 8.582
alpha: 90
beta: 119.7
gamma: 90
cell_volume: 262.220
crystal_density: 3.044
atoms_sites: ["Si1", "Si2", "O1", "O2", "O3", "O4"]
atoms_x: IEsmANByNQAwezEAEAwqAGCsGwCQNAQA
atoms_y: cOMQALBFPACgmgYAoGcbACAQAgBgbwgA
atoms_z: wNQzAMBPLACA+jQAUAgCADAXMQAAzS0A
atoms_occupancy: 0
atoms_u_iso: AH0AAOCrAAAAfQAAoAkBAAD6AADA2gAA
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:
AAAAAAAAAAAAAAAIAAAAAAAAAAAIwAEAAAEACAkAAAAACBAgQoCEAEBB0AAgFYAQEWAICSADQwQhZgDDZAYCsABMImQLFMi2kIREg8gj2FFQMtBFYx5in8dAT1T1rGQIs9oxeKdp7Nou13+eP8/3+nV16r05x1LXabDL+V==


formula: Si O2
compound: Ellora Caves, India
pub_title: New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 10.1 GPa
formula_title: <missing>
a: 7.803
b: 4.382
c: 8.366
alpha: 90
beta: 118.7
gamma: 90
cell_volume: 250.913
crystal_density: 3.181
atoms_sites: ["Si1", "Si2", "O1", "O2", "O3", "O4"]
atoms_x: IDImAJCFNQBgOzIA8L0pAPDGGwDgFgQA
atoms_y: YDkRAMCqOgCwDAcAkIUcAODqAgAQTgYA
atoms_z: oAM0APB5LADAljUAAFgCALA8MQCgLS0A
atoms_occupancy: 0
atoms_u_iso: QJwAAAB9AACAOAEAQJwAAEAZAQDgpQEA
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:
AAAAAAAAAAAAAAAIAAAAAAAAAAABMACAAABAAQJAAAAAARQBAhRBAAQCSQAQAZgASDIBAhkAIYEIWSgk4JEMQTADFB4DoypFHohCJRqlF4nYNBKqMEe8mZ0IdAfp/HYmpfuesDxbkhsWkfie+Ha1P3Gd2s9/ZNtX/9fDsz==


formula: Ba9.5 Ca3.5 Ti Si8 O36 Cl4 H12
compound: Big Creek, Fresno County, California, USA
pub_title: Crystal structure of muirite Ba9(Ca,Ba)(Ca,Ti)4(OH)8[Si8O24](Cl,OH)8
formula_title: <missing>
a: 14.000
b: 14.000
c: 5.625
alpha: 90
beta: 90
gamma: 90
cell_volume: 1102.500
crystal_density: 3.686
atoms_x: AAAAAMBiFACgOA4AgIQeAICEHgCAhB4AgIQeACA7GACgfxcAAIgTAICEHgBgnA0AYJwNAOD4CADg+AgAAAAAAOCYGAA=
atoms_y: AAAAAAAAAACgOA4AgIQeAICEHgAATQgAAE0IAIBnDgDgbwoAAIgTAIDSEQAAAAAAAAAAAOD4CADg+AgAgIQeAOCYGAA=
atoms_z: YJAPAICEHgAAAAAAgIQeAICEHgAAAAAAAAAAAICEHgDgSxAAgIQeAICEHgAAAAAAAAAAAICEHgCAhB4AIHEPAAAAAAA=
atoms_occupancy: gIQeAAAJPQAACT0AgIQeAICEHgDAxi0AQEIPAAAJPQAACT0AAAk9AAAJPQCAhB4AgIQeAICEHgCAhB4AAAk9AAAJPQA=
atoms_u_iso: kIgAADiuAAAwrAAAIBEBACARAQBonAAAaJwAAECmAABgTgEA0P8CABgPAQCwfAAAsHwAAKh6AACoegAAwOgBAAgyAgA=
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:
["Ba1", "Ba2", "Ba3", "Ca1", "Ba1", "Ca2", "Ti2", "Si", "O1", "O2", "O3", "O-H1", "Cl1", "O-H2", "Cl2", "O-H3", "O-H4"]

qdat:
AAAAAAAEAAEAAAAgCACAgUEDAgAgQRRCBEAIhY6AZBNGZEwNKwxIJMlFZtND6KmdeU06ht1mg+twsv8VfjX+nePdWxost6PVi3/AaM7MHnl9AzrizyzTThiurMMcoZymHMeY8z+PM5jEXqROY4HYU7LsyNJaVRmUmbQKjg==


formula: Bi V O4
compound: Schneeberg, Saxony
pub_title: Refinement of pucherite, BiVO4
formula_title: <missing>
a: 5.328
b: 5.052
c: 12.003
alpha: 90
beta: 90
gamma: 90
cell_volume: 323.085
crystal_density: 6.659
atoms_sites: ["Bi", "V", "O1", "O2"]
atoms_x: QEIPAEBCDwDgEAUAQPQbAA==
atoms_y: AAAAAAAAAABAvw8AYLoIAA==
atoms_z: gLAGACAJGACAdxwA0McSAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Bi", "V", "O1", "O2"]
atoms_aniso_u11: AMgAAIjMAADYhgAAsOAAAA==
atoms_aniso_u22: aI0AADB1AAAIygAAqAYBAA==
atoms_aniso_u33: GKsAALCfAAD4MwEAgLYAAA==
atoms_aniso_u12: yOz//0AVAAAoVQAAAAAAAA==
atoms_aniso_u13: AAAAAAAAAAA4vv//oC0AAA==
atoms_aniso_u23: AAAAAAAAAADwb///AAAAAA==
qdat:
AAAAAAAAAAAAAAAAAEAAAAAAAAIAEBAAAEBAAACIgEIgA4CBAwAEdAQAkTACQENYBVBlGDQDGBwOaEnAkVC+SOx8F88r+GEGSR0hvHg9J/d/qtWYQ5cdaNDctl7oeqW+F1a9H7vnJ1X08kvX5Ve7eMW428KuXc39bibleV==


formula: Cu2 As O8 H7
compound: Coller cliff, Montana, USA
pub_title: Euchroite, a heteropolyhedral framework structure
formula_title: <missing>
a: 10.506
b: 10.506
c: 6.103
alpha: 90
beta: 90
gamma: 90
cell_volume: 673.625
crystal_density: 3.324
atoms_sites: ["Cu1", "Cu2", "As", "O1", "O2", "O3", "O4", "O-H", "Wat1", "Wat2", "Wat3"]
atoms_x: ECYuAFjbMABAMSUAwBYpABCJKgBwoRsAYFclABC3MwDABCwA4NkiABDkOAA=
atoms_y: +H88AKDSLQA4oy4AcK0yACC4MQDw8TEAcAElAODrOACAfyMAsFYDAOATKgA=
atoms_z: EOkBAFVYFAAAwS8AcEshAIDjPABQyTEAQNMtACDiEQAgFRYAkP8QAPAVLAA=
atoms_occupancy: 0
atoms_u_iso: wCEKAID8CgBgNwkAgPwKAID2CwAAvgoAwJgLAODyCQCgPg0AQLkQAEAqEwA=
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:
AAAAAAAAAAAAAAAAAAAAgAYAAAIAQAAAAgIDgQADAwAIMGEBADAACOEQYAChOIRjAZjESqgHeBdUIHJPqNwItYJcbxJro+i32hY/ySKnl/lbT9Jtf4vB7dTl3+TO/K07xQ7Fyu1y7/qv/is6esZNHS62DZo+5ti9y3SPu7==


formula: Sr Fe2 As2
compound: Synthetic
formula_title: SrFe2As2
a: 5.5783
b: 5.5175
c: 12.2965
alpha: 90
beta: 90
gamma: 90
cell_volume: 378.465
crystal_density: 6.128
atoms_sites: ["Sr", "Fe", "As"]
atoms_x: AAAAAEBCDwAAAAAA
atoms_y: AAAAAEBCDwAAAAAA
atoms_z: AAAAAEBCDwDACxYA
atoms_occupancy: 0
atoms_u_iso: QBkBAMBdAADAXQAA
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:
 Structural and magnetic phase transitions in the ternary iron arsenides SrFe2As2 and EuFe2As2
 Note: T = 90 K

qdat:
AAAAAAAAAAAAAAAAAgAAAAAAAAAAgAAAAAgAAkgAASAAAAAAAAKgAIAAgAAAkAAKCYAAQAAAAUAhAhgAEQEQ2RKAAADIAQAAQ4FRkIgABCBAaATATPgQADJCwQCGDkCAAAACCjMRnlAEzQQEEWVQAIYRmJkjYICA5gJZmg==


formula: Sr Fe2 As2
compound: Synthetic
formula_title: SrFe2As2
a: 3.9243
b: 3.9243
c: 12.3644
alpha: 90
beta: 90
gamma: 90
cell_volume: 190.413
crystal_density: 6.090
atoms_sites: ["Sr", "Fe", "As"]
atoms_x: AAAAAICEHgAAAAAA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwAA+RUA
atoms_occupancy: 0
atoms_u_iso: kMkAAIBwAABghgAA
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:
 Structural and magnetic phase transitions in the ternary iron arsenides SrFe2As2 and EuFe2As2
 Note: T = 297 K

qdat:
AAAAAAAAAAAAAAAAAgAAAAAAAAAAgAAAABAABCAAAIAAAAAAAAjAAIAAgAAAIAAYBgABAAAAASAEAMAAGACA6AoAAAEgCAAADAEGQEAAAQBAwAMAh0EAABQMEACAwgEAACAAgDABwQAAwIAAgQoAABBAgCCGEAAQYgGCIE==


formula: Eu Fe2 As2
compound: Synthetic
formula_title: EuFe2As2
a: 5.5546
b: 5.4983
c: 12.0590
alpha: 90
beta: 90
gamma: 90
cell_volume: 368.292
crystal_density: 7.458
atoms_sites: ["Eu", "Fe", "As"]
atoms_x: AAAAAEBCDwAAAAAA
atoms_y: AAAAAEBCDwAAAAAA
atoms_z: AAAAAEBCDwAAKxYA
atoms_occupancy: 0
atoms_u_iso: EHIAAHBJAADwhwAA
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:
 Structural and magnetic phase transitions in the ternary iron arsenides SrFe2As2 and EuFe2As2
 Note: T = 10 K

qdat:
AAAAAAAAAAAAAAAAAIAAAAAAAAAAQAAAAACAAKQAAFAAAAAAAAAsQCAAIAAAJAABMUEAAEAAABSIQIQwBACiE0JBAAALIADAEEKKFAkQAEIQCJEgSZMkAAM8KUABOLICAAQQCCRVM0wgRMEEgg0TEAJRIsFiVggMBiQmlI==


formula: Eu Fe2 As2
compound: Synthetic
formula_title: EuFe2As2
a: 3.9062
b: 3.9062
c: 12.1247
alpha: 90
beta: 90
gamma: 90
cell_volume: 185.003
crystal_density: 7.423
atoms_sites: ["Eu", "Fe", "As"]
atoms_x: AAAAAICEHgAAAAAA
atoms_y: AAAAAAAAAAAAAAAA
atoms_z: AAAAAEBCDwAQIBYA
atoms_occupancy: 0
atoms_u_iso: MMAAADCOAAAAlgAA
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:
 Structural and magnetic phase transitions in the ternary iron arsenides SrFe2As2 and EuFe2As2
 Note: T = 297 K

qdat:
AAAAAAAAAAAAAAAAAIAAAAAAAAAAQAAAAAEAAIgAACAAAAAAAABJACAAIAAAEAABQIQAAgAAABEBABBABAQIFQMEAAANAAIAAgQIiCCAABAQCIBBCGhgAADggwAAiggEAACAAgIQCDIABgBACAShAACCCQAiMIAAZCAImQ==


formula: Pb7 Cl2 F12
compound: <missing>
formula_title: <missing>
a: 10.267
b: 10.267
c: 3.9844
alpha: 90
beta: 90
gamma: 120
cell_volume: 363.731
crystal_density: 7.986
atoms_sites: ["Pb1", "Pb2", "Pb3", "Cl1", "Cl2", "F1", "F2", "F3", "F4"]
atoms_x: 0KwjAPALNgAAAAAAVVgUAKuwKAAA7gIAoCslAGDSBABA5zIA
atoms_y: YFIqAACGJAAAAAAAq7AoAFVYFACA1yUAQMoiAID6NACgfiwA
atoms_z: gIQeAAAAAACAhB4AAAAAAICEHgCAhB4AAAAAAAAAAACAhB4A
atoms_occupancy: 0
atoms_u_iso: QAABACD9AACwxgEAwFcBAMBXAQBAGQEAAHcBAGBhAgAgSAEA
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:
 Laurelite: Its crystal structure and relationship to alpha-PbF2
 Note: Re-examination of the crystal by H Yang and A Kampf showed that
 it was twinned, and the partially occupied sites were relicts.

qdat:
AAAAAAAAAAABAAAAAAAAIAAEAAIABAAQAIAIAAAABAEAgAAQEAgIEBgAICBAgQIIEEGGAAGCAEAIIQRBCEMAhiMARkEBiEwGExEBmAmIiZkTgTIgJOiZixZkmSZh2SDZJkm4y2B5oTZGSZnSi2V0MfCAWxnpUji2JLD+FV==


formula: Cu3 V2 O8
compound: Synthetic
pub_title: Crystal structure of a new form of Cu3V2O8
formula_title: <missing>
a: 6.2493
b: 7.9936
c: 6.3776
alpha: 90
beta: 111.49
gamma: 90
cell_volume: 296.441
crystal_density: 4.711
atoms_sites: ["Cu1", "Cu2", "V1", "O1", "O2", "O3", "O4"]
atoms_x: AAAAAOAZEADgUQ8AEKQAAEAvDgAAqh4A4OItAA==
atoms_y: AAAAAGD6DgAQwCUAYIUuADAMHgBQUSwAAKoeAA==
atoms_z: AAAAADDlFwCgpwgAcCQCANDOFQDgiQ4A8G8EAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Cu1", "Cu2", "V1", "O1", "O2", "O3", "O4"]
atoms_aniso_u11: MNkAAOCrAACQfgAAUJEAAHDfAAAQvQAAoPAAAA==
atoms_aniso_u22: AEsAAMBdAAAASwAAYIYAAECcAADAqAAA0GsAAA==
atoms_aniso_u33: sMwAAFCqAACAcAAAkOIAAGCfAABwrQAA8IcAAA==
atoms_aniso_u12: AAAAANAHAADg/P//YPD//2AiAAAg0f//kAEAAA==
atoms_aniso_u13: YLgAADCOAAAwXAAAUJEAAOCrAAAwjgAAwHYAAA==
atoms_aniso_u23: AAAAAEAGAAAAAAAAQO3//1AtAACg3f//QO3//w==
qdat:
AAAAAAAAAAAAAAAAAAgAAAoAAAQAAAADIAAIgCIEAAAwkQAoAQAAdIkKAAAh4AAUkAhRgYFBgYuKCAHlnygQ5AUBQ4zwwOhJKYV5kIbE7neSpjj8YjchuFa/bn5qcc94vzY5y3ZLm5f9xb/eiweP/+Nk0r67da29663/+8==


formula: Cu2 V2 O7
compound: <missing>
formula_title: <missing>
a: 7.8468
b: 5.6213
c: 10.18
alpha: 103.61
beta: 109.71
gamma: 45.74
cell_volume: 302.746
crystal_density: 3.740
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:
 Electronic structure and magnetic properties of monoclinic beta-Cu2V2O7:
 A GGA+U study
 Note: theoretical study, in a triclinic setting

atoms_sites:
["Cu1", "Cu2", "Cu3", "Cu4", "V1", "V2", "V3", "V4", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14"]

atoms_x:
4EYuABDJFwDwPyUAsMMOAOD4IQCwBAAAIBAbAFAEPQCgyzQAYD0IABBrFgCgKDIA8J0mAGDgCgAwliAAgG4RANByHACAmisA0J4dANCdAAAwah8AMGs8AA==

atoms_y:
oAM0AKADNABgBQkAYAUJAHALGwBwCxsAkP0hAJD9IQDAehAA0I8sAOB/MQDgfzEAIIkLACCJCwBQBAsAUAQLALAEMgCwBDIAYMweAGDMHgCgPB4AoDweAA==

atoms_z:
kBA8APB8HwAQjB0AcPgAAGAGDQAgfhEAoAIwAOCKKwBAQg8AwMYtAKBDCADgQBYAYMU0ACDIJgBQOwYAMEkYALDNNgDQvyQAMLkWAFDLBwDQTyYAsD01AA==

qdat:
AAAAAAAAAAAgAAAAAAAQABAAIAgAYAAAFCgAAAEAAVkCUAAACQhAgQCFKCAUEMoSAkOIwEEG5QUEMihRPk0rHwFENvZwWqiRWEYe2jCt3hKBg801NeQdoVXRp53jHdf6twvn+UfHn/Y9C/sb+7dMm3f2bPhP3nz2y3UhtZ==


formula: Cu2 V2 O7
compound: Synthetic
formula_title: <missing>
a: 7.687
b: 5.54982
c: 10.09
alpha: 104
beta: 110.45
gamma: 46.17
cell_volume: 290.958
crystal_density: 3.892
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:
 Electronic structure and magnetic properties of monoclinic beta-Cu2V2O7:
 A GGA+U study
 Note: this is a modification of the monoclinic structure from the
 Calvo & Faggiani (1975) paper, in the triclinic setting

atoms_sites:
["Cu1", "Cu2", "Cu3", "Cu4", "V1", "V2", "V3", "V4", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14"]

atoms_x:
YJ4uAKBmFwBgoiUAoGoOABBuIgCQjTwA8JoaAHB7AABgxTQAoEMIAHApFgDwuTIAkN8mABBPCgAAniAA4KkRAABrHAAgXysA4JMdACDLAAAgdR8A4D08AA==

atoms_y:
AA00AAANNAAA/AgAAPwIAGAWGwBgFhsAoPIhAKDyIQBAhxAAwIEsAKAuMQCgLjEAYNoLAGDaCwAgwQoAIMEKAOBHMgDgRzIAAKoeAACqHgAAXx4AAF8eAA==

atoms_z:
QC48AEBfHwDAqR0AwNoAACAADQBghBEA4AgwAKCEKwBAQg8AwMYtAKAqCADgWRYAYN40ACCvJgAAQAYAgEQYAADJNgCAxCQAUKMWADDhBwCwZSYA0Cc1AA==

qdat:
AAAAAAAAAAAgAAAAAAAEAAQABAQAIQAAAQMAAAAQABKIMEAAACIUJEAIFESBBInJGAMpWgAkQZkCYkcQKNSiVaCQWQVjOOgMnboKSWXiHzVgClfY/zA4+oeTDlmm+tHMc85XG29LTV8zfDxxs8e9t2Ytvq2rP41Hv+d+sb==


formula: Mg4 Si6 O22.82 H13.64
compound: Germany
formula_title: <missing>
a: 13.395
b: 27.016
c: 5.2765
alpha: 90
beta: 90
gamma: 90
cell_volume: 1909.456
crystal_density: 2.242
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 refinement of a sepiolite/indigo Maya Blue pigment
 using molecular modelling and synchrotron diffraction

atoms_sites:
["Mg1", "Mg2", "Mg3", "Mg4", "Si1", "Si2", "Si3", "O1", "O-H2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "Wat10", "Wat11", "Wat12", "Wat13", "Wat14"]

atoms_x:
AAAAAAAAAAAAAAAAAAAAAAA1DADg4AwAgHMMAICjBACAowQAQH4FAMDCBAAAIw8AgOQOAODUDgBgkA8AQEIPAEB4BgDgXCIAgIQeAICEHgBAWSAA

atoms_y:
IMUBAIAgBQCw5wgAgHMMACCsAQBwlggAwOMLAMDUAQCgbgUAUN4IAKDHCwCgKAAAkBUFACASCgCAfwoAQEIPAHBsDwBAxvn/QFoLAABxAgAAQQoA

atoms_z:
QEIPAMDGLQBAQg8AwMYtAGASJACgNyMAwMgDAEC+JABgWwMA4N8hAOAWBAAgUxQAAJ8kAIDMEgDAMTEAgKMEACB2IwAA9AEAQEIPAEBCDwCASCgA

atoms_occupancy:
AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AIDQOwBAjiwAACc4AACYOgCA3g8A

atoms_u_iso:
IMUBACDFAQAgxQEAIMUBAOCrAADgqwAA4KsAAMDaAADA2gAAwNoAAMDaAADA2gAAwNoAAMDaAADA2gAAwNoAAECWAQAA4gQAAOIEAADiBAAA4gQA

qdat:
AAAAAAABAAAAAAAGQEAEQKioJEMDhCCvRKPAJzVi35Tr1JvlKPv3bOUXxLeq/em/8njf3vr+XV/jWK9vf3b2w6+3/vHPd2axWaM/3//z+Xf/KVtu0/qyONtr7f7/6v9v9Uh22jHqmQt/3/X2d3TfEfVTOaaHVUi/+z9+yX==


formula: Mg2 O11.376 Si3 C1.083 N.136 H5.48
compound: Synthetic
formula_title: <missing>
a: 13.271
b: 27.072
c: 5.2748
alpha: 90
beta: 90
gamma: 90
cell_volume: 1895.091
crystal_density: 2.350
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 refinement of a sepiolite/indigo Maya Blue pigment
 using molecular modelling and synchrotron diffraction
 Note: Sepiolite with indigo forming Maya Blue

atoms_sites:
["Mg1", "Mg2", "Mg3", "Mg4", "O1", "O2", "O3", "Si1", "Si2", "Si3", "O4", "O5", "O6", "O7", "O8", "O9", "Wat10", "Wat11", "Wat13", "C1", "C2", "C3", "C4", "C5", "N", "Oin", "C2*", "C3*", "C4*", "C5*", "N*", "Oin*", "C1*", "C2**", "C3**", "C4**", "C5**", "N**", "Oin**", "C2***", "C3***", "C4***", "C5***", "N***", "Oin***", "Wat15", "Wat16", "Wat18"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAAAAACAAAAAAAFIEACQKSwIiMDhCB9EmOQE2SyvzzvZG/u3F7/jutX8Xjb+V7X+1q923bdrx39Wrdt6//+/fr3en1Of3m8Puj//X/d/+/Xu5yy8raYzLXe6+6/a/9u7SctXJRrREK2/9v///brmKpJjdEiVNJ3/v7v9T==


formula: V1.94 Mo.04 (Cu2.64 Zn.36) O8
compound: Tolbachik volcano, Kamchatka Peninsula, Russia
formula_title: <missing>
a: 6.2695
b: 8.0195
c: 6.3620
alpha: 90
beta: 111.96
gamma: 90
cell_volume: 296.662
crystal_density: 4.724
atoms_sites: ["V", "Mo", "Cu1", "Zn1", "Cu2", "Zn2", "O1", "O2", "O3", "O4"]
atoms_x: KEEPAChBDwAAAAAAAAAAAKhWEACoVhAAENYAANAXDgBgsx4A4PstAA==
atoms_y: 2MolANjKJQAAAAAAAAAAALAEDwCwBA8AMHQuAPAeHgAgWSwAwIoeAA==
atoms_z: uKMIALijCAAAAAAAAAAAAKgcGACoHBgAcAsCAFDCFQCQpw4AIIEEAA==
atoms_occupancy: QDQ7AIA4AQAAtjUAAFMHAAC2NQAAUwcAAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: sGgAALBoAACwswAAsLMAAFiiAABYogAAkJcAAFCqAACQlwAAMKcAAA==
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:
 Pseudolyonsite, Cu3(VO4)2, a new mineral species
 from the Tolbachik volcano, Kamchatka Peninsula, Russia

qdat:
AAAAAAAAAAAAAAAAAAgAAAwAAAQAAAAGIAAEgBIEAAAwkIAMAQAAbQhSAAAIyAAWRASGQYAiwUeyiAIuM2gDVAoASr3uOSGRUxx8sEx01b0K/ye3YElZLN/M+2rYH398NsPby/fo3RPdK/ueakn+37Ns5dPmy12/Nr/b11==


formula: O H2
compound: Kohen Station, Antarctica
formula_title: <missing>
a: 4.497479
b: 4.497479
c: 7.322382
alpha: 90
beta: 90
gamma: 120
cell_volume: 128.269
crystal_density: 0.933
atoms_sites: ["O", "H1", "H2"]
atoms_x: VVgUAFVYFADghhsA
atoms_y: q7AoAKuwKAAwDDcA
atoms_z: YL8DAMD8CwCwFwEA
atoms_occupancy: AAk9AICEHgCAhB4A
atoms_u_iso: 0
atoms_aniso_label: ["O", "H1", "H2"]
atoms_aniso_u11: cHsAALBJAQAQCAEA
atoms_aniso_u22: cHsAALBJAQDAwQAA
atoms_aniso_u33: wF0AACCAAADgDwEA
atoms_aniso_u12: gD4AAKClAADgYAAA
atoms_aniso_u13: AAAAAAAAAADQOQAA
atoms_aniso_u23: AAAAAAAAAAAwdQAA
pub_title:
 No evidence for large-scale proton ordering in Antarctic ice from powder neutron diffraction
 Note: T = 100 K
 Note: known as ice-IH

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAABACAEAAAAAAAAIAAAAAAEAAACAABCCAQAABAAQAAAABAAQEBAAKAEACBAgADAAAFAIAQAAAmhABwACAAgFEIAMECIBAVgAGBBUhAGAEUMEAAJRAWAOgQMgAsRkEC5A6IQCAgCVIYgFwB==


formula: O H2
compound: Synthetic
pub_title: Ice II: A proton-ordered form of ice Note: T = -75 C, P = 0.3 GPa
formula_title: <missing>
a: 7.78
b: 7.78
c: 7.78
alpha: 113.1
beta: 113.1
gamma: 113.1
cell_volume: 304.251
crystal_density: 1.180
atoms_sites: ["O1", "O2", "H1", "H2", "H3", "H4"]
atoms_x: oKkQAMAsHQAgEgoAIDUZAGDiKwAgOi0A
atoms_y: AHcBAMDGLQAgNgQAIIMMAKB5GADgYwwA
atoms_z: wBb3/4BDFABAZ/T/INH//+AbGAAA+RUA
atoms_occupancy: 0
atoms_u_iso: 4H0BADBgAQCgnwEAoJ8BAKCfAQCgnwEA
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAAAAAAAAAAAAAABAAAAEAAAAAAAAACAEAAAAAAAAAAAAAAQBAAAAQAAAAAAAAAABAAIEAAAQAAAAAgAEABAAAgQAAAAAAAAAAIQAQgABAAAAAIAABEAAQACAIAACAAAA==


formula: O H2
compound: Synthetic
pub_title: Structure of ice IV, a metastable high-pressure phase Note: T = 110 K, synthesized at 4-5.5 kb
formula_title: <missing>
a: 7.60
b: 7.60
c: 7.60
alpha: 70.1
beta: 70.1
gamma: 70.1
cell_volume: 375.394
crystal_density: 1.275
atoms_sites: ["O1", "O2", "H1", "H2", "H3", "H4", "H5", "H6"]
atoms_x: wDcXAPA3BQDA1AEAgIsIAEDRDACATxIAgG0NAAAXEQA=
atoms_y: MDv5//A3BQDA1AEAgPwKAEAkFADAY///wLYGAEAGGQA=
atoms_z: QGDx//A3BQDA1AEAQJwAAIDl+f8A6e7/gD/r/4DH/v8=
atoms_occupancy: AAk9AAAJPQCAhB4AgIQeAICEHgCAhB4AgIQeAICEHgA=
atoms_u_iso: ABJ6AAASegDwdwEA8HcBAPB3AQDwdwEA8HcBAPB3AQA=
atoms_aniso_label: ["O1", "O2"]
atoms_aniso_u11: iIUBAJgbAQA=
atoms_aniso_u22: GBQBAJgbAQA=
atoms_aniso_u33: eGMBAJgbAQA=
atoms_aniso_u12: oLD//xhh//8=
atoms_aniso_u13: gGz//xhh//8=
atoms_aniso_u23: CKT+/xhh//8=
qdat:
AAAAAAAAAAAAAAAAAAEAAAAAAAAAQAQAACAAAgAAAIAAgUAAAAAAAAAUMACAUIAAAAAIBAwEAQwABEAQAgCAVAApAAVAEAQQCQEaggCJBgAAoAEhByBWgIYBcgUEgSJIgdAhAiCOKFIJRBOrIAaB1SISgugwACQAJIiCAC==


formula: O H2
compound: Synthetic
pub_title: Ice VII, the densest form of ice Note: T = 223 K, P = 2.5 GPa
formula_title: <missing>
a: 3.30
b: 3.30
c: 3.30
alpha: 90
beta: 90
gamma: 90
cell_volume: 35.937
crystal_density: 1.665
atoms_sites: ["O", "H"]
atoms_x: AAAAAEBgCgA=
atoms_y: AAAAAEBgCgA=
atoms_z: AAAAAEBgCgA=
atoms_occupancy: AAk9AICEHgA=
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAACAAAAAAAAAAABAAAAAAAAAAIAAAAAAAABAAAAAAAACAAAAAAAAgAAAAAACAAAAAAAgAAAAABAAAAAAEAAAAABAAAA==


formula: (Bi.75 Pt.125 Pb.125) S.796 Se.026
compound: Lac Sheen, Abitibi-Temiscaminque, Quebec, Canada
formula_title: <missing>
a: 5.86
b: 5.865
c: 5.86
alpha: 90
beta: 90
gamma: 90
cell_volume: 201.402
crystal_density: 7.737
atoms_sites: ["Bi", "Pt", "Pb", "S", "Se"]
atoms_x: AAAAAAAAAAAAAAAAgIQeAICEHgA=
atoms_y: AAAAAAAAAAAAAAAAgIQeAICEHgA=
atoms_z: AAAAAAAAAAAAAAAAgIQeAICEHgA=
atoms_occupancy: wMYtACChBwAgoQcAgJUwAECWAQA=
atoms_u_iso: kIoDAJCKAwCQigMA2GcBANhnAQA=
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:
 Crerarite, a new Pt-Bi-Pb-S mineral from the Cu-Ni-PGE deposit at Lac Sheen,
 Abitibi-Temiscaminque, Quebec, Canada

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAACAAAAAAAAAAAAAAEAAAAAAAAYABAAAAAAAAAEAAAAABABgAAAAAAEAAAABAAAAAAAAwAAACAQAAAAAgAAAQEAAAABAAAGBAAAACAAAQAAAABgAAQIAAAGAADCAAABAADDAA==


formula: Pb3 Mn.901 Ag1.049 Sb5.049 S12
compound: Uchuc-Chacua, Lima, Peru
formula_title: <missing>
a: 19.3645
b: 12.7287
c: 8.7571
alpha: 90
beta: 90.059
gamma: 90
cell_volume: 2158.492
crystal_density: 5.489
pub_title:
 Crystal structure of uchucchacuaite, AgMnPb3Sb5S12, and its relationship with
 ramdohrite and fizelyite
 Note: Sample ID R100213

atoms_sites:
["Pb1", "Pb2", "Pb3", "MnM2", "AgM2", "SbM2", "Ag1", "Sb1", "Sb2", "Sb3", "Sb4", "Sb5", "S1", "S2", "S3", "S4", "S5", "S6", "S7", "S8", "S9", "S10", "S11", "S12"]

atoms_x:
KJsPANgnDwB4KgMAABYIAAAWCAAAFggAoKcIABiCFQAAHBsAENkHALi5/P8AXAMAUC4YANCK//84Xw4AMLYUALA/BgCoDAoAcIEYALjz/v9AnA8A+ND1/9CxBQCAwQkA

atoms_y:
CAw3APDNNwAoDzcAgPQIAID0CACA9AgAaL8KACChBwAA/TQAIFknABAtJwCgwDUA0Kc8ADjMLQBQwQIAgLouAJBgPABIfy4AaAYAAAirLgBItAMA6BgsAIhtAADgzS4A

atoms_z:
IMMXACAY+v9ocSYAcLUHAHC1BwBwtQcAYAYmAEBSJwB4iiUA8HAXAAjqJgAoxQgACMH1/zC1MwAAcOr/aNwkAIBaOQDwBCQAqDgaAOA8GgB4KggAYP8nAGByFACwOwoA

atoms_occupancy:
AAk9AAAJPQAACT0AIP42AKD9AgCg/QIAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
iGwBAMiVAQA4UwEAGFoBABhaAQAYWgEAeKMCANghAQBADwEAwAIBAFAdAQCIDQEA2CEBAJBQAQD4MwEAgC4BACAvAQBYHwEA2BwBAIghAQDIIgEAaB4BANAzAQCIFwEA

atoms_aniso_label:
["Pb1", "Pb2", "Pb3", "MnM2", "AgM2", "SbM2", "Ag1", "Sb1", "Sb2", "Sb3", "Sb4", "Sb5", "S1", "S2", "S3", "S4", "S5", "S6", "S7", "S8", "S9", "S10", "S11", "S12"]

atoms_aniso_u11:
6I4BABDVAQCIbAEA6I4BAOiOAQDojgEAcHQCAHhjAQAQ/gAAcCABAHAlAQAYKAEAKIYBAAB3AQBQLAEAuDcBAOhrAQA4FwEAkCgBAAgpAQAoDgEAOAgBAPicAQDIOwEA

atoms_aniso_u22:
eF4BANhJAQA4bAEAYBwBAGAcAQBgHAEACBMDAMAHAQAwCwEAcPMAAHAvAQD4/AAAEDUBAHCxAQBIOQEA8DEBALhGAQDYWAEAQEEBAJh/AQCYLwEAWEwBAAgaAQBIEQEA

atoms_aniso_u33:
iFgBAEiiAQDAIAEA2GIBANhiAQDYYgEAyGICAFD6AACAJAEAYPQAADgDAQCIAwEAoKoAABjJAAAANgEA2CEBABDbAABI7gAAkOwAACC8AADoKgEAWAYBAJjkAACI+QAA

atoms_aniso_u12:
oN3//wjk//8YCwAAiOH//4jh//+I4f//aHgBABgQAADA/v//+P3//9Du//8A3f//aFEAAJiG//+oSAAAiMP//1Ch//8w7v//sOv//1D7//94xP//CO7//3js//8wDAAA

atoms_aniso_u13:
uCQAACjT//9w+f//mAMAAJgDAACYAwAAkHr//wDx//9g6///MAIAAED3//+4AQAAOPr//3jY//+Q7f//QAYAALjt//+oGwAA8AoAAND9//9A7f//YPX//5AkAADYHQAA

atoms_aniso_u23:
2Nz//zgEAABQ9v//oA8AAKAPAACgDwAAuN7//7AOAADIGQAAEAkAALDw//+gDwAA4Pf//0jq///I7P//mBIAAMgZAAA4+v//wCEAAPAFAAA4GAAAmBcAAPDs//94FAAA

qdat:
AAAAAIAAABBAACEEUIQCIjAxEJo0pmijNNLs7xuPf8X/x3eL3/f+9b/7//v/7+/+//3z//77//57v3t/H/f//fv///////n/+/3/z7f//5fr3/97fz39+d/Pv/368//98/af/eHMm+4cbuYYo+zSDAhEAQAgAAAAAAAAAA==


formula: Pb3 Mn.919 Ag1.041 Sb5.041 S12
compound: Inakuraishi mine, Shakotan peninsula, Shiribeshi, Hokkaido Island, Japan
formula_title: <missing>
a: 19.3462
b: 12.7251
c: 8.7472
alpha: 90
beta: 90.017
gamma: 90
cell_volume: 2153.406
crystal_density: 5.499
pub_title:
 Crystal structure of uchucchacuaite, AgMnPb3Sb5S12, and its relationship with
 ramdohrite and fizelyite
 Note: Sample ID R070760

atoms_sites:
["Pb1", "Pb2", "Pb3", "MnM2", "AgM2", "SbM2", "Ag", "Sb1", "Sb2", "Sb3", "Sb4", "Sb5", "S1", "S2", "S3", "S4", "S5", "S6", "S7", "S8", "S9", "S10", "S11", "S12"]

atoms_x:
0J0PAOgmDwBgKQMAOBAIADgQCAA4EAgA+KQIAJh/FQA4GxsAMNwHAKi6/P9YWQMAkC8YAGCM//8YXA4AQLUUAMhABgC4EAoAMIAYAFj0/v94mw8AGM/1/yCtBQCwvgkA

atoms_y:
cAg3AKDSNwBQBTcAwPUIAMD1CADA9QgAiMIKAOCkBwA4BjUA6FknABAoJwB4wDUAOK48AMjDLQAwyAIAuMMuAMhaPACofi4A2AkAAEinLgCgtgMAOAosAAhmAADAzy4A

atoms_z:
YMkXAMAY+v9IcyYA4K4HAOCuBwDgrgcAYAYmAGhSJwCIkyUAiGoXAGjpJgBIvggAUMn1/1C9MwCQbOr/mNkkAIhXOQCoBiQAuDwaADBCGgCwMwgAOPAnAHCAFABYNAoA

atoms_occupancy:
AAk9AAAJPQAACT0AYBc4AKCAAgCggAIAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
YGIBAKiDAQAoOwEAUE8BAFBPAQBQTwEAoJkCAMgJAQB4+gAAIPMAAOAAAQAQ7wAAcBsBAJg0AQDgIwEACB8BAPgpAQDQEAEAsPkAABgPAQB4EwEA2BcBABg3AQAQAwEA

atoms_aniso_label:
["Pb1", "Pb2", "Pb3", "MnM2", "AgM2", "SbM2", "Ag", "Sb1", "Sb2", "Sb3", "Sb4", "Sb5", "S1", "S2", "S3", "S4", "S5", "S6", "S7", "S8", "S9", "S10", "S11", "S12"]

atoms_aniso_u11:
+HkBAKi1AQCYQwEACIgBAAiIAQAIiAEAUE4CALAwAQBA2AAAuPYAABgAAQBY8gAA0GUBAEBQAQBQEwEACAEBAHhAAQBIFgEAoCIBAOjzAAAw7QAAEOUAAEiOAQDwDgEA

atoms_aniso_u22:
8FkBAJg+AQAAVAEAuAABALgAAQC4AAEAoAcDAIj5AABg/gAAUOYAAIgSAQBA8QAA+C4BAPCBAQCAJAEA8CcBAKBjAQCIIQEACPcAAKB3AQCABgEAIFIBAIgSAQCIDQEA

atoms_aniso_u33:
YFMBALiWAQC4GQEAWGUBAFhlAQBYZQEAyHYCACDzAADwGAEAqPwAACjwAACY6QAAsL0AAJjLAADQMwEAcDQBAPjZAAB4+gAAQNMAAJjBAADgRgEAMBABAFAEAQC47AAA

atoms_aniso_u12:
qMv//2je//+ADAAAqPP//6jz//+o8///kHgBAIARAACo/f//SAMAADj6//8Q4f//qE0AAKCc//94PAAAOMP//6Ch//+Q7f//4AEAAEjg///gz///OOv//0Do//84BAAA

atoms_aniso_u13:
aC4AAMjY///4/f//iCwAAIgsAACILAAAoGr//+D3//+47f//CAcAAAj9//9gBAAA+Pj//8Dg//8Q9f//gBEAADjr//9QFAAAQAsAANDz//+YDQAA6P7//wAeAAC4AQAA

atoms_aniso_u23:
INb//xAEAACA+P//iPr//4j6//+I+v//aN7//ygKAADAIQAA6AMAAADx//8YCwAAGPz//+ALAAD45P//ADIAACgoAAAw+P//4B8AAGAJAAAYFQAAGCkAAHjd//+QFQAA

qdat:
AAAAAIAAABBAACEEUIQCIjAwkJo0omijNNLk3xvPL8X753dLz/ff9Zb6v3/37++///3z//77//d//39/n////fv////v//j/+f/37/f9/8v3/9+/vz//fc/v3/7967/68fvffvDOybYONXMMUrxpBgREAIAgAAAAAAAAAA==


formula: Si2 Al4 B4 (Ca1.21 Na.79) K.72 Cs.07 O18
compound: Vico volcanic complex, Capranica, Viterbo Province, Latium, Italy
formula_title: <missing>
a: 4.8507
b: 16.6156
c: 20.5445
alpha: 90
beta: 90.245
gamma: 90
cell_volume: 1655.816
crystal_density: 2.405
pub_title:
 Capranicaite, (K,_)(Ca,Na)Al4B4Si2O18: a new inosilicate from Capranica,
 Italy, with a peculiar topology of the periodic single chain [Si2O6]

atoms_sites:
["Si1", "Si2", "Al1", "Al2", "Al3", "Al4", "B1", "B2", "B3", "B4", "CaM1", "NaM1", "CaM2", "NaM2", "KA", "CsA", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18"]

atoms_x:
gPkwAMAVDADQXA8AsCcPAIALLgAAgi0A4IMPABD/DgCQtS0AAMTw/5AGLQCQBi0AMJ4OADCeDgDQfCsA0HwrAJDMJQDATAcAIJ4tALCGLQCgMg8AoK8PAFA1IAAQCBoAwFk7AKB0BACg6gEAwOX6/yCgHABAqyMAoLsmAKDkNABAIQgAAHYWAA==

atoms_y:
oE40ANCkHABQsiAAULIgABB+MABwhzAAACorACAtKwBg9xsAgPobAJBiJgCQYiYAoJ4WAKCeFgCQrSYAkK0mADBLOQCwNzYAcOswAJAHMQAgCyAAgBQgANDHKwBwKS8A0McrAJAsLwAAaxwAIAsgAEBxHACwDCAA4OQ1AODkNQDwhCYAEIgmAA==

atoms_z:
ADwPAKBLDwAwFxgAIHUGAEBfBgAgIhgAEPAEAKCMGQDwNhoAcEoEANA5AADQOQAA4L8eAOC/HgBAQg8AQEIPAEApDwAAPA8AkG4LAGAUEwAwfgsAkAwTAEC1GQBAawQAYLkEAJAUGgCAURoA8G8EACA2BACwFxoAoIYaAGAKBACwgRkAQBoFAA==

atoms_occupancy:
AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AACfJAAAahgAQDslAMDNFwAA8isAwEUEAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
APoAAPDrAACwmgAAsJoAADCnAACgpQAAMPIAAGADAQAQpAAAQLUAAKDXAACg1wAAYNEAAGDRAACAqQMAgKkDAADbAQDQ4gEAUL0BACDFAQDAuwEAkMMBAGADAQBAAAEAEAgBAMAMAQAA4QAAoPAAADDyAAAA+gAAEAgBACD9AADADAEAQBkBAA==

atoms_aniso_label:
["Si1", "Si2", "Al1", "Al2", "Al3", "Al4", "B1", "B2", "B3", "B4", "CaM1", "NaM1", "CaM2", "NaM2", "KA", "CsA", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18"]

atoms_aniso_u11:
MPIAAPDSAACwgQAAAH0AAEC1AACwswAAsGgAALBPAAAwpwAAYJ8AAMDaAADA2gAAYNEAAGDRAAAwlQMAMJUDAIDUAABA5wAAwGoCABA0AgDAagIAgGQCALCaAAAAyAAAgKIAACDLAABwlAAAMKcAAKCMAABgnwAAENYAAADhAACwswAAsLMAAA==

atoms_aniso_u22:
YDUBADAkAQBAnAAA0J0AALCBAACwgQAAEFkAAIA+AABwrQAA8KAAALDMAACwzAAAUMMAAFDDAACwewEAsHsBAADCAQAQhQEAsPgBAPAwAgAg9wEA8BcCAJCwAABguAAAEKQAAHDGAACQsAAAQJwAADDAAADwuQAA4JIAALCBAABQkQAAcK0AAA==

atoms_aniso_u33:
4MQAAJDJAACwswAAQLUAAKC+AABguAAA8BcCAIB9AgCQlwAA4N0AAADhAAAA4QAA4N0AAODdAACg6wUAoOsFAPD4AgCQOgMA8NIAANDoAADw0gAAQM4AAOC+AQDQfgEAoNEBAJCRAQBwXAEAAJABAMCJAQCwlAEAQK8BALCUAQBg5AEAEOkBAA==

atoms_aniso_u12:
0NX//5Do//9w/v//4Pz//1D7//8Q9f//UPv//8ASAABgCQAAcP7//wAAAAAAAAAAkAEAAJABAACAqP//gKj///AKAADA4P//UJf//1CX//9ws///4H///4Dz//+Qz///gAwAAAAyAAAAAAAAcOX//9AHAABwFwAAAOf//yAcAACw6///QAYAAA==

atoms_aniso_u13:
8AoAACADAAAgAwAAkAEAANAHAACgDwAAIAMAALAEAAAgAwAAsAQAACADAAAgAwAAcP7//3D+///AdgAAwHYAADARAADAEgAAMPj//9AHAADg/P//wBIAAHD+//+g3f//oPb//5Do//9gCQAAUMn//wAAAABg1///MFwAALBPAAAQJwAA8CMAAA==

atoms_aniso_u23:
AAAAAAAAAADg/P//0AcAAFD7//+wBAAA0O7//wAAAACA8///QAYAAHD+//9w/v//cP7//3D+//9wFwAAcBcAAAAZAADwCgAAAM7//2A7AACwTwAAkM///4A+AABQRgAA4Mr//yC4//+QMwAAECcAABDD///g4///ENz//3AXAABg8P//kBoAAA==

qdat:
AAAAAAAAQAQAiCAAUAAFIMEhq2IxGdESsyipyF02NZq/r76X7++9u+9v/vP//n3/v/7/8/te9+43/j85Xxfd7E73/39v+b5fG+Ra/VRtGoNt/3z+v1tde6e/yi46G9iXDH+7/fX9j5cvqfOi9k8IVBEeu/vX/VzbXWbN0X==


formula: As3 (Al3.12 Fe.88) O18.9 H4 Ba.51
compound: Cap Garonne, France
pub_title: Bariopharmacoalumite, a new mineral species from Cap Garonne, France and Mina Grande, Chile
formula_title: <missing>
a: 7.772
b: 7.772
c: 7.772
alpha: 90
beta: 90
gamma: 90
cell_volume: 469.460
crystal_density: 2.598
atoms_sites: ["As1", "Al1", "Fe1", "O1", "O2", "H2", "Ba1", "O3", "O4"]
atoms_x: gIQeAFCsCABQrAgAMK8HAJA0NgAgmTIAAAAAAICEHgDA3ikA
atoms_y: AAAAAFCsCABQrAgAkD8XAJA0NgAgmTIAgIQeAABTBwDA3ikA
atoms_z: AAAAAFCsCABQrAgAMK8HAJA0NgAgmTIAgIQeAICEHgDA3ikA
atoms_occupancy: AAk9AICbLwCAbQ0AAAk9AAAJPQAACT0AQGAKAMCYCwAA2xoA
atoms_u_iso: MOwBAIC1AQCAtQEAwFECAECWAQBg5AEAoP0CAKAJAQDgHAMA
atoms_aniso_label: ["As1", "Al1", "Fe1", "O1"]
atoms_aniso_u11: IJMBAIC1AQCAtQEAgDICAA==
atoms_aniso_u22: gBkCAIC1AQCAtQEAgDICAA==
atoms_aniso_u33: gBkCAIC1AQCAtQEA4J8CAA==
atoms_aniso_u12: AAAAABDD//8Qw///gMH//w==
atoms_aniso_u13: AAAAABDD//8Qw///gD4AAA==
atoms_aniso_u23: AAAAABDD//8Qw///gD4AAA==
qdat:
AAAAAAAAAAAAAEAAAAAgAAAIAAAgAAQAAgAAAAQAEACACACAEAEAABAEAQCAIBAQAAgICAgACBAAQIECBAggAQIIIIIIAIIQQQQgBBCEAQQBCEIRBAIRCEQgEIiEQgIhEAiAiIRIgIiIiIARESICRECIEiRIgSJIkCRIEg==


formula: As3 (Al2.32 Fe1.68) O18 H4 Ba.51
compound: Mina Grande, Chile
pub_title: Bariopharmacoalumite, a new mineral species from Cap Garonne, France and Mina Grande, Chile
formula_title: <missing>
a: 7.850
b: 7.850
c: 7.850
alpha: 90
beta: 90
gamma: 90
cell_volume: 483.737
crystal_density: 2.551
atoms_sites: ["As1", "Al1", "Fe1", "O1", "O2", "H2", "Ba1", "O3", "O4"]
atoms_x: gIQeALC1CACwtQgAYMAHAOAvNgAgmTIAAAAAAICEHgBAHSoA
atoms_y: AAAAALC1CACwtQgAoPwXAOAvNgAgmTIAgIQeAKBcCABAHSoA
atoms_z: AAAAALC1CACwtQgAYMAHAOAvNgAgmTIAgIQeAICEHgBAHSoA
atoms_occupancy: AAk9AIBmIwCAohkAAAk9AAAJPQAACT0AQGAKAAA1DAAANQwA
atoms_u_iso: UHIBALCzAACwswAAAHECAGBnAQCAtQEAYOQBAIA4AQCAOAEA
atoms_aniso_label: ["As1", "Al1", "Fe1", "O1", "O2"]
atoms_aniso_u11: 4CgBALCzAACwswAAYN4CAGBnAQA=
atoms_aniso_u22: sJQBALCzAACwswAAQJYBAGBnAQA=
atoms_aniso_u33: sJQBALCzAACwswAAYN4CAGBnAQA=
atoms_aniso_u12: AAAAAHDl//9w5f//oA8AAECi//8=
atoms_aniso_u13: AAAAAHDl//9w5f//oIwAAECi//8=
atoms_aniso_u23: AAAAAHDl//9w5f//oA8AAECi//8=
qdat:
AAAAAAAAAAAAAIAAAABAAAAQAACAABAACAAAACAAgAQAQAQAQBAAAIAgCAQCAQEAAICAgIABAgAECBBAgQQAIIEEEEEAEIIQQQgBCCEAQgCEIQhCAQhEIhAIhEIiAREICICIiERAiIiIgBESIgSJASBEiJECRJEgiSBIEk==


formula: (Mn.87 Ca.07 Fe.04 Zn.01 Mg.01) P2 Al2 O13 F2 H10
compound: the Hagendorf-Sud pegmatite, Bavaria, Germany
formula_title: <missing>
a: 9.887
b: 9.796
c: 6.054
alpha: 92.70
beta: 99.83
gamma: 97.10
cell_volume: 571.913
crystal_density: 2.472
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:
 Nordgauite, MnAl2(PO4)2(F,OH)2*5H2O, a new mineral from the Hagendorf-Sud
 pegmatite, Bavaria, Germany: description and crystal structure

atoms_sites:
["Mn", "Ca", "Fe", "Zn", "Mg", "P(1)", "P(2)", "Al(1)", "Al(2)", "Al(3)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "F(1)", "F(2)", "Ow1", "Ow2", "Ow3", "Ow4", "Ow5", "H(11)", "H(12)", "H(21)", "H(22)", "H(31)", "H(32)", "H(41)", "H(42)", "H(51)", "H(52)"]

atoms_x:
gBUkAIAVJACAFSQAgBUkAIAVJABAazYAkNMoAAAAAAAAAAAAMJowABCXMABQtjAA8Bk8AEBgPACAwTEA8KkkALCpIwAgBykAwHE3AKDGOQBwSTIAIBMnAFDpGwAgQTAAQKEtAEBwMQAgIjEAAAooAKC6IgBA+hoAYOMWAIAANACg3TEAwCUzAIAwLAA=

atoms_y:
IBwZACAcGQAgHBkAIBwZACAcGQBAjiwAYMsaAICEHgAAAAAA4NUrALAbKgAAgi0AEOM0AMD2JQDwuRkAsN0SANDWHACwziEAcOY1ADAOJgAAhAMAIBwyACBkDQCgeBQAoI0EAOB7CACg/QIAYKA2AMC6LwAANQwA4NoNACBNFQDA2RUAoG4FAGC0CQA=

atoms_z:
4F8VAOBfFQDgXxUA4F8VAOBfFQAgLSsAcAw4AAAAAACAhB4AkDwLAIBxHQBwzTUAQLMqADAKLwDAEzYAIJkAAGBrKgDAhAYAIO4PAKCuCwBAtyEAMIQKAHDxFgBQhRsAcA08AEBfHwCAyycA4P4HAKDlBgAAQB8AAJQRAMDZFQCgNyMAAGsDAOC6PAA=

atoms_occupancy:
wBk1AMBFBAAAcQIAQJwAAECcAAAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
oAkBAKAJAQCgCQEAoAkBAKAJAQAgywAAwNoAAOCrAAAgywAAgLsAAAD6AADA2gAAAPoAAGDqAAAA+gAA4CgBAKAJAQBg6gAAgDgBAAD6AAAgSAEAQBkBAAB3AQCAOAEAwNQBAKCAAgCAqQMAQJACAKCGAQBg5AEAwEUEACBCAgCg/QIAYN4CAEB+BQA=

qdat:
AAAAAAAAAABAAAAAICAAAKQAAFAABAIAPEAWAEiGAcEYEAwpBGBhpA2BnG1AliKhB6H4JGcrmSxzcL79D+fRUafj959v5Kvd63/7nd7W9u/k2/uf/79/5vdvx7+97rv/Pef53r/O/5f1f/ub7x++/3/+2a8r/N/3679v95==


formula: Ca2 Al7 P4 O39 H33
compound: Silver Coin mine, Nevada, USA
pub_title: Iangreyite: a new secondary phosphate mineral closely related to perhamite
formula_title: <missing>
a: 6.988
b: 6.988
c: 16.707
alpha: 90
beta: 90
gamma: 120
cell_volume: 706.537
crystal_density: 2.468
atoms_x: AAAAAKuwKADAIQoAAAAAAKuwKAAAAAAAIC8aAACmDgAAAAAAVVgUACBxDwDAsAcAQMk3AFVYFADA1AEA
atoms_y: AAAAAFVYFABVWBQAAAAAAFVYFAAAAAAAwA8NAABTBwAAAAAAq7AoAAAAAACAYQ8AoOQbAKuwKADgbh8A
atoms_z: AAAAAIBJEwDg9jIAgIQeAIA4AQBgARIAgCwDAIBbEAAgvhcAwEUEAICEHgDg/gcAALgLAEBCDwBAiRgA
atoms_occupancy: AAk9AICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
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
atoms_sites:
["Ca1", "Ca2", "Al1", "Al2", "P1", "P2", "O1", "O2", "O3", "O-H1", "O-H2", "O-H3", "O-H4", "Wat1", "Wat2"]

qdat:
AAAAAAIAAAAAEAAAAIJAAIAAAkAAAAmIEACZBCAoAICJABSUgEQQ40AVICEwqwLLQwQLgVJCTCIGuCRMoOoQYMGVMJXFkNYwN8wkgcAtkNxE/DIjGG5oSCQdkbGDh6TKDCrQsiMastOmzD9FQwUJM1p0nR8nRS7xUjErEW==


formula: Cu4 S O10
compound: Douglas Hill mine, Yerington, Nevada, USA
formula_title: <missing>
a: 13.1117
b: 9.8654
c: 6.0307
alpha: 90
beta: 103.255
gamma: 90
cell_volume: 759.302
crystal_density: 3.904
atoms_sites: ["Cu1", "Cu2", "Cu3", "Cu4", "S1", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10"]
atoms_x: 8EgXAIBfDADIigwAqDEXAIDiBgCAVxkAQAUVAIBZCAAwyg8A0NQUAPDxGABAmQ0AEAoiAJA7BwBwEyIA
atoms_y: GDgtAEggHwD4Hx8A4FEtAMD/MABw7DQA0LklAADqJAAwexgAoKglAGD3NAAgdDQAAKYnAECsJwAwtycA
atoms_z: cFQTABAPHQDwrP7/ILgxADAaCwCwkCMAIJshAKBYKgCQoQ8AsKcCAADiBACgnA4AkF4WADBlCwCQuDkA
atoms_occupancy: 0
atoms_u_iso: UHgAAHCUAAAggAAA0IQAAGDqAACQlwAA4MQAACAvAQBAlgEAMFwAADB1AADA1AEAIMUBACDFAQBg5AEA
atoms_aniso_label: ["Cu1", "Cu2", "Cu3", "Cu4", "S1", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10"]
atoms_aniso_u11: wKgAANC2AABwlAAAMMAAAMAMAQCAuwAAgLsAAKCGAQCAOAEAYG0AAIC7AACAOAEA4KsAAOAiAgCgjAAA
atoms_aniso_u22: gHAAADCOAABQeAAAkH4AALCaAACAuwAAgLsAAOAiAgAA7gIAYG0AAAB9AADASwMAAPoAAGDqAAAA+gAA
atoms_aniso_u33: YFQAADB1AABQeAAAYFQAANAaAQDAXQAAgLsAAOAuAACAuwAAIE4AAIA+AAAA+gAAQIoDAAD0AQDAyAMA
atoms_aniso_u12: MN///wDn///Q7v//wOD//4Dz//8AAAAAQKL//4BE///A5v7/oA8AAMDg//8A+gAAoA8AAMBj//8AAAAA
atoms_aniso_u13: MCoAAEAfAACgKAAAwCsAAOBHAACAPgAAYPD//+CrAAAAfQAAgD4AAIA+AABAHwAAIE4AAKAPAAAg0f//
atoms_aniso_u23: kAEAABD1//8gAwAAYPD//6APAACgDwAAgMH//+Cx///gsf//4C4AAKAPAAAgTgAAAH0AAKAPAABAov//
pub_title:
 Discreditation of ''orthobrochantite'' (IMA 78-64) as the MDO1 polytype
 of brochantite
 Note: This is the MDO1 polytype of brochanite, that used to be called orthobrochantite

qdat:
AAAAAAAAQAAAAEAAIAAEBQBBCABCBAgAFAUTEQITQmcRAG4FA1IBpSVEg/Pl4QNT/nU98yYP6jevXccmv8u+N+n3u/X++9633/73f7/v3yf/8/L/9rt3vxV/327937fX7f/vX99y+z/f1Oj+546bf/Pp/PZ7XvyvMv/vnn==


formula: Pb3 Se O5
compound: Tsumeb, Namibia
pub_title: Plumboselite, Pb3O2(SeO3), a new oxidation-zone mineral from Tsumeb, Namibia
formula_title: <missing>
a: 10.5384
b: 10.7452
c: 5.7577
alpha: 90
beta: 90
gamma: 90
cell_volume: 651.986
crystal_density: 7.952
atoms_sites: ["Pb1", "Pb2", "Se", "O1", "O2", "O3"]
atoms_x: AAAAABAiDwCAhB4AQGwIAICEHgAAFiYA
atoms_y: AM81ACjbBgCgFjUAAAk9AOAgLABAwzgA
atoms_z: wK4xAFCXMQDAzjQAAO4CACCxLgAgwysA
atoms_occupancy: 0
atoms_u_iso: wD4BAPA2AQAAdwEAIMUBAGDqAACAtQEA
atoms_aniso_label: ["Pb1", "Pb2"]
atoms_aniso_u11: 0DMBAIA4AQA=
atoms_aniso_u22: IP0AAHBDAQA=
atoms_aniso_u33: oIYBAOAoAQA=
atoms_aniso_u12: AAAAADCt//8=
atoms_aniso_u13: AAAAAMBdAAA=
atoms_aniso_u23: oJL//0AfAAA=
qdat:
AAAAAAAAAAAAABAAAAAFAABAAACBAABIAIABIAAgANAiIFALgCCAApAKJakCkbKgIIEiTjyamlcMCDk8kBFVJ0pFeu4jv4pXw0a//1JXzZjWdVnrPN//TXUhpGeV+5fmhVt0S9ztu7I3cMgTbv7W3cDMyhlzdsuAJqqopR==


formula: Ca (Cu.96 Mg.04) As O5 H
compound: Higgins mine, Arizona, USA
pub_title: Crystal structure and chemistry of conichalcite, CaCu(AsO4)(OH)
formula_title: <missing>
a: 7.3849
b: 5.8379
c: 9.1937
alpha: 90
beta: 90
gamma: 90
cell_volume: 396.362
crystal_density: 4.323
atoms_sites: ["Ca", "Cu", "Mg", "As", "O1", "O2", "O3", "O4", "O5", "H"]
atoms_x: ACEHACBOAAAgTgAAkHcWAMB/CwAgBSEA4J4XAOCqFQDgewgAQEIPAA==
atoms_y: IIQQAMD5///A+f//IKjx/6Bv8P+gzvX/QF8fAKCS///AgA8AgN4PAA==
atoms_z: IP0ZAGC9LQBgvS0AoGkjAPCeKgAAMCoAwPQdABCrHADglikAAPIrAA==
atoms_occupancy: AAk9AACYOgAAcQIAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: IIAAAFCRAABQkQAAkH4AAOCrAAAA+gAAYOoAAIC7AABAnAAAwNQBAA==
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:
AAAAAAAAAAAAAAAAAAAAAABAAEBAIAAAIEAFICAAUQEABGAXQEA0ACAAHUgGVZICFoQYbFBCqokoyQ0mOUeoY4UmzXWX6mq9H7U06tw51yfb3UmvVf1/7qm93b/vaz1ef7Th+6/vz78/d5y/v/792/++2NOu9/u79v9C+f==


formula: Ca (Cu.87 Mg.13) As O5 H
compound: Gozaisho mine, Fukushima, Japan
pub_title: Crystal structure and chemistry of conichalcite, CaCu(AsO4)(OH)
formula_title: <missing>
a: 7.429
b: 5.852
c: 9.215
alpha: 90
beta: 90
gamma: 90
cell_volume: 400.618
crystal_density: 4.219
atoms_sites: ["Ca", "Cu", "Mg", "As", "O1", "O2", "O3", "O4", "O5", "H"]
atoms_x: kCIHAJBMAACQTAAAcHQWAPCQCwBA1iAA4J4XAOCqFQCgXAgAwAkOAA==
atoms_y: wHoQACDq//8g6v//UKDx/6Bv8P8gkPX/4G4fAACD//9gkA8AQNEMAA==
atoms_z: UPUZACC3LQAgty0AcFgjAFB2KgBAHSoAAMkdAOCAHACgkCkAgLkqAA==
atoms_occupancy: AAk9AMAZNQBA7wcAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: MMAAAPAEAQDwBAEA8AQBAKAJAQCghgEAwFcBAIA4AQCAOAEAgDgBAA==
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:
AAAAAAAAAAAAAAAAAAAAAACAAECAQAAAQIAJQEAAYgIACEAqgIBYAEAAPRAVzSgIKwhRaOEHtlixcjKNdQyh1i8XNJZftLG2tqjT7fHlbLtu/777zfe3+ud78/f63fl+/U6bPj982/N3f+tf//7fu7v+r7/2/9357+59+d==


formula: Ba Fe3 Si2 O8.77 (Cl.23 H.77)
compound: Esquire
pub_title: Ferroericssonite, the Fe2+ analogue of ericssonite, from eastern Fresno County, California, U.S.A.
formula_title: <missing>
a: 20.3459
b: 7.0119
c: 5.3879
alpha: 90
beta: 94.874
gamma: 90
cell_volume: 765.877
crystal_density: 4.425
atoms_sites: ["Ba", "Fe1", "Fe2", "Fe3", "Fe4", "Si", "O-H1", "Cl1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: aLwNAAAAAAAAAAAAAAAAAJCPCACYMggAMGMDADBjAwBgmwkAEFYDABBKCgAoUAoAkAgDAA==
atoms_y: AAAAAGj2DwAAAAAAgIQeAICEHgDwxQ0AAAAAAAAAAAAAAAAA8PsOACDcEgBA3xIAgIQeAA==
atoms_z: gLwOAAAAAACAhB4AgIQeAOArDQDQfCsAoP8KAKD/CgAw6isA4MgpAEBmOwAQDx0AILsLAA==
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AQP8uAMAJDgAACT0AAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: YJUAABC9AADAwQAAMKcAAEBqAADgYAAAwFECAMBRAgDgxAAAsJoAABCkAAAQpAAA0J0AAA==
atoms_aniso_label: ["Ba", "Fe1", "Fe2", "Fe3", "Fe4", "Si", "O-H1", "Cl1", "O2", "O3", "O4", "O5", "O6"]
atoms_aniso_u11: kLAAAGDqAACw5QAAMNkAAICJAABghgAAoHQEAKB0BACAuwAA0IQAAPDSAABQwwAAoIwAAA==
atoms_aniso_u22: kH4AAODEAABguAAAoKUAAMBdAABAUQAAoIYBAKCGAQDAXQAAcK0AAPCgAAAQpAAA4KsAAA==
atoms_aniso_u33: UJEAADCOAACgpQAAIIAAABBZAABwSQAAoAkBAKAJAQDgKAEA0J0AAMB2AABghgAAQJwAAA==
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAADQBwAAAAAAAAAAAAAAAAAAcBcAADD4///wCgAAAAAAAA==
atoms_aniso_u13: aBAAAJAzAABABgAAYDsAAPAKAAAgAwAAwF0AAMBdAADQIAAAcBcAAIAMAABQFAAA4C4AAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAgAwAAAAAAAAAAAAAAAAAAgPP//xD1///AKwAAAAAAAA==
qdat:
AAAAAAAAAAIAAAABAAAECEBAAEAAADAiAAACJCgwAYkgAyAYJYBjAAkBiKETqhRW1CqKEAJYDCXQYEg1wRUmTkqKgl1qkgJMQ/S+DXgMbiknkziBdQ4NmitF/2xedLMclA5Je9UIjREfRw2sf3jJm+rg3g8qzOj3qnpJtR==


formula: V10 Na3 O43 H30
compound: Synthetic
formula_title: <missing>
a: 12.0248
b: 17.121
c: 18.140
alpha: 90
beta: 106.242
gamma: 90
cell_volume: 3585.550
crystal_density: 2.402
atoms_occupancy: 0
pub_title:
 Rakovanite, Na3{H3[V10O28]}*15H2O, a new member of the
 pascoite family with a protonated decavanadate polyanion

atoms_sites:
["V1", "V2", "V3", "V4", "V5", "V6", "V7", "V8", "V9", "V10", "Na1", "Na2", "Na3", "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", "H29A", "H29B", "H30A", "H30B", "H31A", "H31B", "H32A", "H32B", "H33A", "H33B", "H34A", "H34B", "H35A", "H35B", "H36A", "H36B", "H37A", "H37B", "H38A", "H38B", "H39A", "H39B", "H40A", "H40B", "H41A", "H41B", "H42A", "H42B", "H43A", "H43B"]

atoms_x:

atoms_y:

atoms_z:

atoms_u_iso:

atoms_aniso_label:
["V1", "V2", "V3", "V4", "V5", "V6", "V7", "V8", "V9", "V10", "Na1", "Na2", "Na3", "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"]

atoms_aniso_u11:

atoms_aniso_u22:

atoms_aniso_u33:

atoms_aniso_u12:

atoms_aniso_u13:

atoms_aniso_u23:

qdat:
AAAAAAAAEgAgwGAQA4w4FFgQt3Q7jFeZn8v1rVfWvvV7n/+v/7v/5f//////3////////9//7/f///f///////7////+9/v/vv/+/3/t//f++//vfw/Xu53b0DzU0HmKAMQEBBAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Pb Bi4 Se8 Ag2
compound: Zalesi uranium deposit, northern Moravia, Czech Republic
formula_title: <missing>
a: 13.203
b: 4.186
c: 15.280
alpha: 90
beta: 109.164
gamma: 90
cell_volume: 797.692
crystal_density: 7.871
atoms_x: 4CUOANCRAgDwnCIAoDkrANB5OACwcAcA0CIIAKCEEgAQbBoAoMElABAYKACw0jEAsB86AIAxFwDA0xYAQLwcAICEHgA=
atoms_y: QEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAuvv/QEIPAAAAAAA=
atoms_z: YPUTALAFNgDgJhIAcCs3AKAbFwAgKh8A8PkGAECOLABQqwQA4FgrAECEHQDATAcAEHAqACAXNwDADTcAgBQgAICEHgA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AIB9NADARQQAAGMuAACmDgA=
atoms_u_iso: kEACAFBAAQAQOgEAQEsBAHB1AQAQ7wAA4A8BAJAUAQCAHwEAIC8BAAD0AQDAPgEAMPIAACC5AwAA4gQAIK0FAADiBAA=
atoms_aniso_u11: QOEBAMA+AQDAcAEAEFMBAMBXAQBAnAAAoAkBAOAoAQBAGQEAwFcBAOClAQDgKAEAoAkBAOCZAwBAnAAAQAcEAA==
atoms_aniso_u22: 4HMBAPBPAQDAPgEAkEYBAKBUAQBAGQEAwNoAAEAZAQBAGQEAQBkBAKB6AwBAGQEAYOoAAMC2BgAAxAkAIKEHAA==
atoms_aniso_u33: oHoDAPAdAQAAEwEA4CgBAKCGAQCgCQEAIEgBAKAJAQDgKAEA4CgBAGDqAABgZwEAwNoAAMDaAACAqQMAwMIEAA==
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u13: kPsAAFBGAADQhAAAgD4AAHAwAADgLgAAwF0AAGBtAAAgTgAAYG0AAKCMAACAPgAAIE4AAAB9AACAPgAAgLsAAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
pub_title:
 Litochlebite, Ag2PbBi4Se8, a new selenide mineral species from Zalesi,
 Czech Republic: description and crystal structure

atoms_sites:
["Pb1", "Bi1", "Bi2", "Bi3", "Bi4", "Se1", "Se2", "Se3", "Se4", "Se5", "Se6", "Se7", "Se8", "Ag1a", "Ag1b", "Ag2a", "Ag2b"]

atoms_aniso_label:
["Pb1", "Bi1", "Bi2", "Bi3", "Bi4", "Se1", "Se2", "Se3", "Se4", "Se5", "Se6", "Se7", "Se8", "Ag1a", "Ag1b", "Ag2a"]

qdat:
AAAAAAAIIAAABAEABAAgIBAAAVoAUgQMKyAHKBoBKZgE7HAhDA/ehc1A7ttTIdx3kt9bGn0/H3yP36c7u1+Nx77fXvfs1U7+W31Pr39498n+ve3e/Ps7iuevXd6q6P9yovf0/Sd4tdx+e4/7KwauYbfu7LFtf5ucF8T3t/==


formula: Ni3 Sn
compound: Jeffrey mine, Asbestos, Quebec, Canada
pub_title: Nisnite, Ni3Sn, a new nickel mineral species from the Jeffrey mine, Asbestos, Quebec
formula_title: <missing>
a: 3.7349
b: 3.7349
c: 3.7349
alpha: 90
beta: 90
gamma: 90
cell_volume: 52.100
crystal_density: 9.395
atoms_sites: ["Ni", "Sn"]
atoms_x: AAAAAAAAAAA=
atoms_y: gIQeAAAAAAA=
atoms_z: gIQeAAAAAAA=
atoms_occupancy: 0
atoms_u_iso: gJ0FAAB9AAA=
atoms_aniso_label: ["Ni", "Sn"]
atoms_aniso_u11: IJkAACCAAAA=
atoms_aniso_u22: EIsAACCAAAA=
atoms_aniso_u33: EIsAACCAAAA=
atoms_aniso_u12: AAAAAAAAAAA=
atoms_aniso_u13: AAAAAAAAAAA=
atoms_aniso_u23: AAAAAAAAAAA=
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAQAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAgAAAQAAAAAAAAAAAAAAQAAAAAAAAAQAAIAAAAAAAAAAAIAAAAAAACAAAAAAAAAAAACAAAAAAB==


formula: Ag17.742 As3.552 Sb.448 S15
compound: Synthetic
formula_title: <missing>
a: 7.5984
b: 7.5984
c: 15.557
alpha: 90
beta: 90
gamma: 120
cell_volume: 777.859
crystal_density: 5.797
atoms_sites: ["Ag1", "Ag2", "Ag3", "Ag4", "Ag5", "As1", "As2", "Sb2", "S1", "S2", "S3", "S4"]
atoms_x: MJAcAOgZEgCAhB4A4MgQAKBEDABVWBQAAAAAAAAAAACAih0AEIMSAFVYFAAAAAAA
atoms_y: 0HggAAgNCQAAAAAAAAAAAAAAAACrsCgAAAAAAAAAAACAfh8AsEEJAKuwKAAAAAAA
atoms_z: MGgSALByBQCAhB4AgIQeAICEHgCoewQAACYRAAAmEQBguggAEJkVABCjGgAAAAAA
atoms_occupancy: AAk9AAAJPQDAHzQAADUMAEAkFAAACT0AAF0vAACsDQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: MOYCANC9AwAgswQAAHECAADiBAAwugEAAMIBAADCAQAwlQMAAMIBAADCAQBAfgUA
atoms_aniso_label: ["Ag1", "Ag2", "Ag3", "Ag4", "Ag5", "As1", "As2", "Sb2", "S1", "S2", "S3", "S4"]
atoms_aniso_u11: YMUCALDAAgBAbAgAIDwDAGBJBgCQJwIAUCECAFAhAgCg8QQA4PABAJAnAgCAnQUA
atoms_aniso_u22: YMUCAPDAAwCAtQEA4CICAADcBQCQJwIAUCECAFAhAgCg8QQA0OIBAJAnAgCAnQUA
atoms_aniso_u33: wIMCAOBhBADQsAEAQJYBAGBhAgBw3wAA0AEBANABAQAQ4wIAcHUBAAD6AABgTwUA
atoms_aniso_u12: 0OgAAJBfAQBQ3AAAUA4BAADuAgAAEwEAcBEBAHARAQBABwQAcPgAAAATAQDAzgIA
atoms_aniso_u13: 6JD//7DF/f+wBAAAAJYAAPCm//8AAAAAAAAAAAAAAABAHwAAkBoAAAAAAAAAAAAA
atoms_aniso_u23: GG8AABDi/v/QBwAA4CgBACBU//8AAAAAAAAAAAAAAADA4P//gAwAAAAAAAAAAAAA
pub_title:
 Fast ion conduction character and ionic phase-transition in silver sulfosalts:
 The case of fettelite [Ag6As2S7][Ag10HgAs2S8]
 Note: T = 400 K

qdat:
AAAAAACAAAAAAEABAIAARAAAACAkIACJECUAASEAICSEQAKRRCgFABDUTJKgFIGakgFoMaCAvRcKAyCVKBWt0YLhPKDA2EBWXqDasUEidwOLACurQ0VsNFEC7jCR9hN8hxajAiFJ6NuoYrjbmH2ZJSFPo/xFD4yxOnTLQt==


formula: Pb4 Cr2 Cl F O10 H2
compound: Mammoth-St. Anthony mine, Tiger, Pinal County, Arizona, USA
formula_title: <missing>
a: 7.6256
b: 11.6081
c: 6.8961
alpha: 90
beta: 90
gamma: 90
cell_volume: 610.434
crystal_density: 6.253
atoms_sites: ["Pb(1)", "Pb(2)", "Cr", "Cl", "F", "O(1)", "O(2)", "O(3)", "O-h4", "H"]
atoms_x: QEIPAFCqHgBAQg8AQEIPAMDGLQAgyxkAQEIPAEBCDwBAyBoAwJEhAA==
atoms_y: kG4kAEBCDwAgZx4AwPANAEBCDwCQQR8AYAwlALD3FgDAxi0AwMYtAA==
atoms_z: ULcHAPBuGQDQlCcAAGUEAHAZCADAoS8AsBgeABBIIAAgEw4AYLQJAA==
atoms_occupancy: AAk9AAAJPQAACT0AgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==
atoms_u_iso: GFUBAGg8AQCQyQAAEFMBAOClAQCAnAEAgGoBADBvAQBgAwEAgDgBAA==
atoms_aniso_label: ["Pb(1)", "Pb(2)", "Cr", "F", "O(1)", "O(2)", "O(3)", "O-h4"]
atoms_aniso_u11: AJABALDlAABg0QAA4CICAGBnAQCAtQEAYGcBAMDaAAA=
atoms_aniso_u22: EGwBAHB1AQDw0gAAQBMCAKADAgAgSAEAAPoAAOAoAQA=
atoms_aniso_u33: YAMBAFBZAQDQtgAA4KsAAGBnAQAgSAEAAPQBAAD6AAA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAMBdAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: AAAAABjy//8AAAAAAAAAACDR//8AAAAAAAAAAGDw//8=
atoms_aniso_u23: kM///wAAAACQ6P//AAAAAECi//8AAAAAINH//wAAAAA=
pub_title:
 Georgerobinsonite, Pb4(CrO4)2(OH)2FCl, a new chromate mineral from the
 Mammoth-St. Anthony mine, Tiger, Pinal County, Arizona: description and crystal structure

qdat:
AAAAAAAAAAAAAAAQAAgAAAACAAAEAAIIBAAIQAAQAgAABMARAgAAAQTAQhQBCAlIIKCFAgDIYDABAQuAiJHhoLABIGy0hSY3BQ0SJlIQhCqBeVCo4GgnSDKuI1dUctRA0CqcIqVDGJc+CJ3hz5CrEVSbHBMpVgkDE20Hpl==


formula: Ca2 Cu As2 O10 H4
compound: the Maria Catalina mine, Tierra Amarilla, Chile
pub_title: Rruffite, Ca2Cu(AsO4)2*2H2O, a new member of the roselite group, from Tierra Amarilla, Chile
formula_title: <missing>
a: 5.8618
b: 12.7854
c: 5.7025
alpha: 90
beta: 109.425
gamma: 90
cell_volume: 403.049
crystal_density: 3.770
atoms_sites: ["Ca", "Cu", "As", "O1", "O2", "O3", "O4", "O5", "H1", "H2"]
atoms_x: UG8iAAAAAABQzw0AUIgOAKBrEgBQLzoAQEUbANBrMgDgnSwAoL82AA==
atoms_y: WIIHAAAAAAAAZwcAMFACAOBOAwDQrAoAsJ0MAJBOCAAgmwgAIAYMAA==
atoms_z: eOkMAAAAAABgWyEAcG0TANC8MQAAZR0AgIshAPBXOgBgLzQAYP87AA==
atoms_occupancy: 0
atoms_u_iso: QJwAAADIAAAAfQAA8LkAAACvAAAQvQAA4MQAAACvAAAAcQIAAHECAA==
atoms_aniso_label: ["Ca", "Cu", "As", "O1", "O2", "O3", "O4", "O5"]
atoms_aniso_u11: EIsAAFCqAACgcwAAYJ8AAMDBAACwgQAAILIAAACvAAA=
atoms_aniso_u22: 4JIAABC9AADAdgAA8NIAAICiAADgxAAAQLUAAHCUAAA=
atoms_aniso_u33: 8LkAAIDUAABAgwAAYLgAAKClAADg3QAAwPMAABCkAAA=
atoms_aniso_u12: UPv//5ABAAAgAwAAoPb//zARAAAQQAAAcLP///Dx//8=
atoms_aniso_u13: YDsAAAAZAACwHQAAADIAANA5AABAHwAAgFcAAEAGAAA=
atoms_aniso_u23: YPD//0C7//9w/v//ALX//6AoAACQAQAAgNr//9Du//8=
qdat:
AAAAAAAAAAAAAAAAIAAgCQAAAkAAAAAoJAAIABRhAIIAAYgACYTKDAkBFEawOBicBOIra4pMCCDzYHLKmXXY2p2LpEeAx3q87fjSaFm4YW3R4gazjqzZpd5N1pyBqXV5uyY1369Nmz1gfO/qqlzrivZv0+jzzq27zl9t95==


formula: Ca Cu4 As4 O26 H22
compound: Jachymov (St. Joachimsthal) ore district, Czech Republic
formula_title: <missing>
a: 6.439
b: 7.999
c: 10.849
alpha: 85.78
beta: 81.22
gamma: 85.05
cell_volume: 549.140
crystal_density: 3.121
atoms_occupancy: 0
atoms_aniso_u11: IMUBAHD4AADgDwEA4PYAAKAJAQCAMgIAYOoAAMDaAACAOAEAgLUBAIA4AQAAdwEAIEICAOAiAgAgQgIAIDwDAICjBADAyAMA
atoms_aniso_u22: YOQBAGAcAQDAPgEAgAYBAKDwAADAVwEAIEgBAIA4AQCghgEAAHcBAKAJAQAA+gAAwNoAACBIAQCgAwIA4BYEAOAiAgDgnwIA
atoms_aniso_u33: YGECAFCeAgCQQAIA0EYCACApAgDgnwIAwM4CAKADAgCggAIAwNQBAMDUAQBADQMAgLUBAICvAgBAigMAQA0DAKB6AwCgegMA
atoms_aniso_u12: UBQAADD4//+A8///sAQAAEAGAAAgTgAAAIP//wAAAADAXQAAoIwAAAAAAAAAAAAAYPD//4BE//+APgAAIFT//wB9AAAAAAAA
atoms_aniso_u13: 4Jj//yCf///Qo///oKv//yCf//+Awf//gMH//0Ci//+ARP//IFT//0AfAABAJf//gMH//0Ci//+Ax/7/YHP//wAG//9AK/7/
atoms_aniso_u23: 4Mr//xB4//8wlP//ILj//2C+//9g8P//wOb+/2Dw//9gc///oBX//0Ci//8gTgAAoJL//+Cx///gsf//4Lf+/+AuAABAHwAA
pub_title:
 Ondrusite, CaCu4(AsO4)2(AsO3OH)2*10H2O, a new mineral species from the
 Jachymov ore district, Czech Republic: Description and crystal-structure determination

atoms_sites:
["Ca", "Cu1", "Cu2", "As1", "As2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "Wat1", "Wat2", "Wat3", "Wat4", "Wat5", "H1"]

atoms_x:
gIQeALC/FwCAijYAgK36/6BaGQBws///wPTr/0B+BQDAKfj/cAQYAFA2CwBQ/iQAwH0cAFDYOwDARBkAwLQwAACIEwCgOA4AkJnv/w==

atoms_y:
AAAAALBhFgDwc/v/yE0XANDq/v9Qhh8AcI4aAOABFACwawwAMGf6/6C3/f/w7/f/QHMLAKCv9v8gUCEAwDkGAJAkDwBwMiEAAJMNAA==

atoms_z:
AAAAAGDkGgAgxxgAWKoWAIjWFACwiw8AULcbAMB9HAAgeBIAgHMMALCtGgCQzxgAwGgTAJB1DgDgcA4AQPQCADASBAAQ/TgAkP8QAA==

atoms_u_iso:
MAUCAMCJAQBggAEA8GgBAHBcAQDgIgIAQJYBAMBXAQCAtQEA4KUBAGBnAQDA1AEA4KUBAAD0AQBAkAIAYFsDAABrAwCALAMAQA0DAA==

atoms_aniso_label:
["Ca", "Cu1", "Cu2", "As1", "As2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "Wat1", "Wat2", "Wat3", "Wat4", "Wat5"]

qdat:
AAAAAAAAABAAAQAAkBAEIQBCABIEAIoFAkKBBAQ0XWQhABwJgvNCCn70AIOs8kR6YN7l++V/QbsNUi/88/27/ur/S9rW/8/8Xzv7u/v9V+/+/3f9de/vf////73//tVvnv///797//d//736+of///79fd17X96VP1Xf+c==


formula: U8 Y1.98 Dy.239 S4 O66 H52
compound: Cervena vein, Jachymov (Street Joachimsthal) ore district, Western Bohemia, Czech Republic
formula_title: <missing>
a: 14.0743
b: 17.4174
c: 17.7062
alpha: 75.933
beta: 128.001
gamma: 74.419
cell_volume: 2776.985
crystal_density: 4.013
atoms_aniso_label: ["U1", "U2", "U3", "U4", "U5", "U6", "U7", "U8", "Y1", "Dy1", "Y2", "Y3", "S1", "S2", "S3", "S4"]
atoms_aniso_u11: oAMCALBcAgAw5gIA0PsBAHA9AgAgjQIAYKwCAFBTAgCQ3AEAkNwBAGDeAgCAuwAAgLUBACDLAADAUQIAwEsDAA==
atoms_aniso_u22: sDABAABFAQDgjAEAsDABAFBAAQCgbQEAYIABAGCAAQCA5wEAgOcBAGBVBADgpQEA4KsAAGDqAABg6gAAwFcBAA==
atoms_aniso_u33: gFEBAAB3AQAgrAEAAEUBAFByAQDwmgEAgLUBAJB4AQBwdQEAcHUBAGDeAgBAGQEAoAkBAGDqAACAtQEAoAMCAA==
atoms_aniso_u12: YN3+/4Cu/v+QWP7/oOP+/4DH/v+gmP7/UGv+/+Ce/v/gAv//4AL//2D8/f9Aov//4DT//2Bz//8g1/7/QCv+/w==
atoms_aniso_u13: kJEBAPDMAQBwJAIAEIUBABC3AQCw+AEA0BQCAPDMAQBAZAEAQGQBAABxAgCAPgAA4CgBAECcAAAgxQEAYGECAA==
atoms_aniso_u23: 8BD//0Dz/v/wxf7/cB3//8D//v/w3v7/IL7+/4Dg/v8QFP//EBT//+C9/f+Awf//wGP//2Bz///A5v7/oJj+/w==
pub_title:
 Sejkoraite-(Y), a new member of the zippeite group containing trivalent cations from
 Jachymov (St. Joachimsthal), Czech Republic: Description and crystal structure refinement

atoms_sites:
["U1", "U2", "U3", "U4", "U5", "U6", "U7", "U8", "Y1", "Dy1", "Y2", "Y3", "S1", "S2", "S3", "S4", "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", "Wat1", "Wat2", "Wat3", "Wat4", "Wat5", "Wat6", "Wat7", "Wat8", "Wat9", "Wat10", "Wat11", "Wat12", "Wat13", "Wat14", "Wat15", "Wat16", "Wat17", "Wat18", "Wat19", "Wat20", "Wat21", "Wat22", "Wat23", "Wat24", "Wat25", "Wat26"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAAAAAIhEAIFABTABDmAIUnZqyYELet4XkjX963J8rHv9u6/3+f/vf//ff+////3Ve/3///r//3////f//+///1/////3+9///3+////7f+b/77/j+92d//h3PV6rcaod30ZuR9Xd1Hbp3SI+zD3QNIhqJKbQkDCiESpR==


formula: Pb5.828 Bi2.12 S8.7 Se.3
compound: La Fossa crater, Vulcano (Aeolian Islands, Italy)
pub_title: Structure refinement of Ag-free heyrovskyite from Vulcano (Aeolian Islands, Italy)
formula_title: <missing>
a: 13.7498
b: 31.5053
c: 4.1475
alpha: 90
beta: 90
gamma: 90
cell_volume: 1796.662
crystal_density: 7.221
atoms_x: yKoZAICEHgCAhB4AkPMNAEgbCwBIGwsA2M8bANjPGwBQ0AIAUNACAFBaBQCwGxEAYNwTAGDcEwDgDhYA
atoms_y: QEIPAAAAAAAAAAAAcIwDABirCgAYqwoAwEIHAMBCBwCI7gsAiO4LALA2BQBAQg8A8OgIAPDoCABIogEA
atoms_z: AAAAAAAAAAAAAAAAAAAAAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAAICEHgCAhB4AAAAAAAAAAACAhB4A
atoms_occupancy: AAk9AADyKwAAFxEAwHI7AID1IACAExwAgPUgAIATHADAijcAQH4FAAAJPQAACT0AgF85AICpAwAACT0A
atoms_u_iso: 0A4DAJAtAQCQLQEAsDABAHBcAQBwXAEAODoBADg6AQCghgEAoIYBAEAZAQBwdQEAcKcBAHCnAQBAGQEA
atoms_aniso_u11: 4DsCABA6AQAQOgEAsDABAFCLAQBQiwEAcEMBAHBDAQCAtQEAgLUBACBIAQAAdwEAQJYBAECWAQBg6gAA
atoms_aniso_u22: 8OwEAOBBAQDgQQEAcFwBAGBOAQBgTgEAgFEBAIBRAQDAVwEAwFcBAFAOAQBgZwEAIEICACBCAgAwiAEA
atoms_aniso_u33: EAICAFAOAQBQDgEAYAMBADA9AQAwPQEA0BoBANAaAQCghgEAoIYBAAD6AAAAdwEA4CgBAOAoAQDQzwAA
atoms_aniso_u12: AAAAANAHAADQBwAAEA4AALAEAACwBAAAwPn//8D5//8A5///AOf//6APAAAAAAAA4JIAAOCSAACQAQAA
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
atoms_sites:
["Pb1", "Pb2", "Bi2", "Pb3", "Pb4", "Bi4", "Pb5", "Bi5", "S1", "Se1", "S2", "S3", "S4", "Se4", "S5"]

atoms_aniso_label:
["Pb1", "Pb2", "Bi2", "Pb3", "Pb4", "Bi4", "Pb5", "Bi5", "S1", "Se1", "S2", "S3", "S4", "Se4", "S5"]

qdat:
AAAAAACAIAAAEIAQCAIAwAAQEwCAIAHQCQAAECQIEEAACSQCEBEwzWYFchQ4U4IoyIEKWIkgIURJUoCcKCAkATCAIAQKIEAQAIAAA5allGYNpQLiiAqFEAyCBAUQICGQgQBAAAAAAAAAAAAAAAAAAAAG7NWhVg5kKmQJEE==


formula: Pb25.6 Bi9.8 Sb10.6 (Cu1.48 Fe.36 Ag.16) S57
compound: Vena, Sweden
formula_title: <missing>
a: 34.07
b: 37.98
c: 4.072
alpha: 90
beta: 90
gamma: 90
cell_volume: 5269.081
crystal_density: 6.682
pub_title:
 The crystal structure of izoklakeite, Pb51.3Sb20.4Bi19.5Ag1.2Cu2.9Fe0.7S114.
 The kobellite homologous series and its derivatives

atoms_sites:
["Pb1", "Bi1", "Pb2", "Bi2", "Pb3", "Bi3", "Sb4", "Bi4", "Sb5", "Bi5", "Pb6", "Bi7", "Sb7", "Pb8", "Pb9", "Pb10", "Bi11", "Sb11", "Bi12", "Sb12", "Pb13", "Bi14", "Sb14", "Pb15", "Pb16", "Pb17", "Bi18", "Sb18", "Pb19", "Sb20", "Sb21", "Bi21", "Pb22", "Pb23", "Bi23", "Cu24", "Fe24", "Ag24", "S1", "S2", "S3", "S4", "S5", "S6", "S7", "S8", "S9", "S10", "S11", "S12", "S13", "S14", "S15", "S16", "S17", "S18", "S19", "S20", "S21", "S22", "S23", "S24", "S25", "S26", "S27", "S28", "S29"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

atoms_aniso_label:
["Pb1", "Bi1", "Pb2", "Bi2", "Pb3", "Bi3", "Sb4", "Bi4", "Sb5", "Bi5", "Pb6", "Bi7", "Sb7", "Pb8", "Pb9", "Pb10", "Bi11", "Sb11", "Bi12", "Sb12", "Pb13", "Bi14", "Sb14", "Pb15", "Pb16", "Pb17", "Bi18", "Sb18", "Pb19", "Sb20", "Sb21", "Bi21", "Pb22", "Pb23", "Bi23", "Cu24", "Fe24", "Ag24"]

atoms_aniso_u11:

atoms_aniso_u22:

atoms_aniso_u33:

atoms_aniso_u12:

atoms_aniso_u13:

atoms_aniso_u23:

qdat:
AAAAQEaAJCKkKEZSPGHsaO9hT9n/f/3/7217t5X+W/oOEyBQCAAH/+7v7/+++0UtFAgAAAAAAAAAAf/99///zOmEAAAAAAAAAAAAAAB//7//raxAAAAAAAAAAAAAAAAAD////rsgAAAAAAAAAAAAAAAAAAP////RAAAAAA==


formula: V10 O43 Na3 H30
compound: Synthetic
formula_title: <missing>
a: 12.0627
b: 17.1745
c: 18.2094
alpha: 90
beta: 106.340
gamma: 90
cell_volume: 3620.084
crystal_density: 2.379
atoms_occupancy: 0
pub_title:
 Novel self-assembled decavanadate clusters forming 1D molecular chains and
 2D molecular arrays: [HMTA-H...H2O][HMTA-CH2OH][H3V10O28{Na(H2O)4}]*4H2O and
 [Na2(H2O)10] [H3V10O28 {Na(H2O)2}]*3H2O

atoms_sites:
["V1", "V2", "V3", "V4", "V5", "V6", "V7", "V8", "V9", "V10", "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", "Na1", "O29", "O30", "Na2", "Na3", "O31", "O32", "O33", "O34", "O35", "O36", "O37", "O38", "O39", "O40", "H1", "H2", "H3", "H4", "H5", "H6", "H7", "H8", "H9", "H10", "H11", "H12", "H13", "H14", "H15", "H16", "H17", "H18", "H19", "H20", "H21", "H22", "H23", "H24", "O41", "H25", "H26", "O42", "H27", "H28", "O43", "H29", "H30"]

atoms_x:

atoms_y:

atoms_z:

atoms_u_iso:

atoms_aniso_label:
["V1", "V2", "V3", "V4", "V5", "V6", "V7", "V8", "V9", "V10", "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", "Na1", "O29", "O30", "Na2", "Na3", "O31", "O32", "O33", "O34", "O35", "O36", "O37", "O38", "O39", "O40"]

atoms_aniso_u11:

atoms_aniso_u22:

atoms_aniso_u33:

atoms_aniso_u12:

atoms_aniso_u13:

atoms_aniso_u23:

qdat:
AAAAAAAAEgBAwGAQAww4JHgQq6hdFH8pr5fd3r/k/+v3v/77////y//7////v////f///7///9///+//v//////ff////+//ef3/7/vfv//377+f/Dvd/nNuwHrTQeUYAxAQECAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Pb Tl (Ag.35 Cu.65) As2 S5
compound: Binnatal, Switzerland
pub_title: Crystal structure refinement of a wallisite-hatchite solid solution
formula_title: <missing>
a: 9.0707
b: 7.7868
c: 8.0386
alpha: 65.828
beta: 65.047
gamma: 74.220
cell_volume: 466.255
crystal_density: 5.704
atoms_sites: ["Pb1", "Tl1", "Ag1", "Cu1", "As1", "As2", "S1", "S2", "S3", "S4", "S5"]
atoms_x: IFckADDIBwBwRAUAcEQFACCiCwBgNBYA0IYhACDCDgCAVxkAIP4EAKC0CgA=
atoms_y: EBgPAFC7EgBg+AYAYPgGAGA9IQAA+zYA8JkWAFCKFgDA4gcAMCoyAFDoMAA=
atoms_z: oC8cAKDZCADAQy4AwEMuABAzFwDAwzoAABkyAEAQKACwRxIAgB8aAOA8OAA=
atoms_occupancy: AAk9AAAJPQDAXBUAQKwnAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: sGIBAKCZAgCwdQIAsHUCAOAoAQDQMwEAQGQBALB7AQBQQAEAcKcBAFC9AQA=
atoms_aniso_label: ["Pb1", "Tl1", "Ag1", "Cu1", "As1", "As2", "S1", "S2", "S3", "S4", "S5"]
atoms_aniso_u11: 4L4BADCCAgCwCwMAsAsDAEBkAQCAgwEA8GgBAGCyAQCQeAEA8JoBAOBzAQA=
atoms_aniso_u22: sBcBAOCZAwCQkQEAkJEBAJAUAQDgDwEAkF8BALCtAQDQGgEAMFYBAEBeAgA=
atoms_aniso_u33: MD0BABACAgAw/wIAMP8CABAhAQBQDgEA8AQBANABAQAwCwEAwNQBAFCLAQA=
atoms_aniso_u12: UJf//1BM//9Aif//QIn//1CX//9QsP//kLb//5CE///gmP//cLP//5BS//8=
atoms_aniso_u13: AIP//3AE//+g6f3/oOn9/4B2//8QeP//AJz///B0//+Aj///ILj//+CY//8=
atoms_aniso_u23: 4Mr///Ap//8AMgAAADIAABDD///gyv//UPv///DY//+w6///MGL//9BY//8=
qdat:
AAAAAAAAAAAABABISIEAAAAAJCQImaFCQECghAEHiNixXqBM+UYOlBWpRrS+M1QX4qD+Of92r/+eKiP/v39v3/6f/7Xe3fb/9/8fvV/9t/3/t/f//6+3+//f7///9///////f//6/////f//7/+/9553/MF+713RrwByqV==


formula: Cu4 Bi3.92 S9
compound: Synthetic
formula_title: Cu4Bi4S9
a: 31.68
b: 11.659
c: 3.972
alpha: 90
beta: 90
gamma: 90
cell_volume: 1467.087
crystal_density: 6.166
atoms_x: EEIIAICrCwCAmhIAgFgdACCBHQBgsgEA8IIFACABEQBA2hcA4EEBADAGBgBgaQkAILsLANBiDgDgORMAIMoVAJAaGQDArxwA
atoms_y: EGUXAACCFADQ6BkAIC4WAIA+GQBgZhYAMAYGABB0CABALw4AkAMIAMDMEwCwrgUAoLUOAECdHQCQVxMA0LcEAPDFFwAgVgcA
atoms_z: wMYtAEBCDwBAQg8AQEIPAEBCDwDAxi0AQEIPAEBCDwDAxi0AwMYtAEBCDwDAxi0AwMYtAEBCDwDAxi0AQEIPAEBCDwBAQg8A
atoms_occupancy: AAk9AAAJPQAACT0AgIQeAICEHgCA0DsAgNA7AIDQOwCA0DsAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: IAcBAJClAQDI6gEASHkCAEieAABo8QAAEBcBAIDtAADI1wAAILIAACCyAACYigAASJ4AAEieAABIngAAwHYAAEieAAAgsgAA
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:
 Redetermination and refinement of the structure of
 tetrabismuth tetracopper enneasulphide Cu4Bi4S9

atoms_sites:
["Cul", "Cu2", "Cu3", "Cu4", "Cu5", "Bil", "Bi2", "Bi3", "Bi4", "S1", "S2", "S3", "S4", "S5", "S6", "S7", "S8", "S9"]

qdat:
AAAAAACAAAAQAQAAgAgRABIAAAFRiEhAikUAkPIAgkKQColABQQB2TIXYsI2qGVRZUhBUmEhwwULFCg7S94dErwfE5x4gzGiiKEIgxggcmq/DyXLwbFIYDGZoICkYCATIQIB96NaxwmdihEyBASIECKEEBDRBA67urbJMm==


formula: Ca Cu (P.5 As.5) O5 H
compound: Tsumeb, Namibia
formula_title: <missing>
a: 7.328
b: 9.123
c: 5.769
alpha: 90
beta: 90
gamma: 90
cell_volume: 385.677
crystal_density: 4.092
atoms_sites: ["Ca", "Cu", "P", "As", "O1", "O2", "O3", "O4", "O-H5"]
atoms_x: YAYmAIBhDwAgZCYAIGQmACCyGQDgAjEAIEcWACCyGQDgEAUA
atoms_y: QCMpAKBVHgDgMxQA4DMUAED0GwCAlhsAgCQuAGDcLABgHiIA
atoms_z: wKkdAIBbEABAXx8AQF8fAIByIQCgMSQAAB0QAOCdLABA6B0A
atoms_occupancy: AAk9AAAJPQCAhB4AgIQeAAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: qLQCAKi0AgCotAIAqLQCAKi0AgCotAIAqLQCAKi0AgCotAIA
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 new mineral hermannroseite, CaCu(PO4,AsO4)(OH), the phosphate analogue
 of conichalcite, from Tsumeb, Namibia

qdat:
AAAAAAAAAAAAAAAAAAAAAAAgABAAEIBAEAACKAAgCkAgBJQCoIAKgAgAQ/MgLjEAQbiCDYUUGrnExdhRYrQ6Ya1ZLkmpPXSRzL3ppy/xVjV/brsf68/z+n5u9b33/aZ3v37Z8u/fv57v39v99///9373v9n+/X/f7/36su==


formula: C13
compound: Synthetic
pub_title: The crystal and molecular structure of fluorene Note: Positions of hydrogen atoms were not given
formula_title: <missing>
a: 8.49
b: 5.721
c: 18.97
alpha: 90
beta: 90
gamma: 90
cell_volume: 921.397
crystal_density: 1.126
atoms_sites: ["C1", "C2", "C3", "C4", "C5", "C6", "C7"]
atoms_x: QC8nACD5IgCgMSQAYHEpAMDGLQAgvSwAgJUwAA==
atoms_y: wIsiAIAwLACAQikAgIodAGByFAAgxBYAQEIPAA==
atoms_z: 4OAMAODyCQDgjQUAgCYEAED1BgAgiQsAQEIPAA==
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
qdat:
AAAAAAAAAAAgAAAAAAAQAAQACIAgACCQCQBAChQAAIDAUVAQAKGAjhgUEoKMUWWSQIUYCBiEKRzDU8hoIimcwE4gcxAzdiZkYJDIs6eA2LsmRTMg21W5ILZqNUJtnbOKLxukNtb8tZsk0KkFIV1Llucriq222ysRCHaY1W==


formula: Pb4.819 Sb4.161 S11
compound: Synthetic
formula_title: <missing>
a: 21.285
b: 23.525
c: 4.019
alpha: 90
beta: 90
gamma: 90
cell_volume: 2012.432
crystal_density: 6.132
pub_title:
 Substitution experiments and structure investigations on Ag-Tl-bearing boulangerites
 - a contribution to the rayite problem

atoms_sites:
["Pb1", "Pb2", "Pb3", "Sb4", "Pb4", "Pb5", "Sb5", "Sb6", "Pb6", "Sb7", "Pb7", "Sb8", "Sb81", "Sb9", "S1", "S2", "S3", "S4", "S5", "S6", "S7", "S8", "S9", "S10", "S11"]

atoms_x:
ME8XAGCwEgBwsAwA0PUbAND1GwAgBQgAIAUIAEANAwBADQMAsJsdALCbHQBAwRcAANoWABCiEQDARQQA4GkLAGATDwAA3AUAgIUJACBTFADgkhkAIMsAAIC0FgBgBxEAwNoAAA==

atoms_y:
MN///5DFCQDgthMAIGEaACBhGgCQ9gUAkPYFAGAyDgBgMg4A8NoHAPDaBwBgnREAAHUSAJA6HACgCQEAwEQZACDFAQBgARIAwJ4KACDEFgBATg0AoOoaAABfBQBAQg8AAE0IAA==

atoms_z:
QEIPAEBCDwBAQg8AwMYtAMDGLQDAxi0AwMYtAEBCDwBAQg8AwMYtAMDGLQDAxi0AwMYtAMDGLQBAQg8AwMYtAEBCDwDAxi0AQEIPAEBCDwBAQg8AwMYtAMDGLQDAxi0AwMYtAA==

atoms_occupancy:
AAk9AAAJPQAACT0AAEAfAICQHAAAIiQAoHkYACD/IQCAHxoAoJwnAOAzFADAGiAAgH4fAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
KOQCAPA1AgDAUQIAGOoCABjqAgBA1gIAQNYCAIi2AgCItgIA6JwCAOicAgAI8AIAmLACAND/AgDQQQIAADACAEA1AwBwXQUAqMcDALhiAwB4xgIA8G8EAOBFAgAAjwIAwEcCAA==

atoms_aniso_label:
["Pb1", "Pb2", "Pb3", "Sb4", "Pb4", "Pb5", "Sb5", "Sb6", "Pb6", "Sb7", "Pb7", "Sb8", "Sb81", "Sb9", "S1", "S2", "S3", "S4", "S5", "S6", "S7", "S8", "S9", "S10", "S11"]

atoms_aniso_u11:
kN8DAPgoAgD4DwIAuAMDALgDAwCQcgIAkHICALDJAwCwyQMAGPoBABj6AQCQdAAAEOMHAAADAgBotAEAoE8BAMB1AQBgcQEACN4AAMh3AQAgSAEAuEsBAHDyAQCwcQEAYMEBAA==

atoms_aniso_u22:
+CMCACAuAgBAbQIAeIoCAHiKAgBA/gIAQP4CAHCSAgBwkgIAeNUCAHjVAgBY9AMAWGMDAOAmAwDoCwIAqIMBADDnAQC4zQEA6EcCAMCXAgDoPQIAADoCAFgeAgBoLAIAGJUCAA==

atoms_aniso_u33:
cKYCAMB5AgBgegIA8C8DAPAvAwD4EwMA+BMDAAgcBAAIHAQAiAYDAIgGAwAoagQAAOMDAFjWAwBwKx4AiL8DABBEBgB42gwAiC4IAFAYBgDwzgQAgMsJAFDBAgAgDgQASIMCAA==

atoms_aniso_u12:
oEYAAJjR///wHgAAUDwAAFA8AABguf//YLn//2jF//9oxf//IDUAACA1AADItAAAoMn//1Bg//8QYwAAOHIAADDV//+AIAAA+N///5gSAACQyv//CLf//5BMAABIMAAA0Pj//w==

atoms_aniso_u13:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

atoms_aniso_u23:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

qdat:
AAAAAAAABBBAAIAACBACYCABIAGBUfBAKxMKBwEPKVQwGUIfr50id1yz8MUdmNEVBO+GGqEL5BKgGAZpjTUW7IMH8YtEvImgQEQgCAEATm1mqZWPTKk+i4MIiAgEAAAAAAKp0r5I+RqtLhiSAgQAAAAAAAAALfzbaeXp1Y==


formula: Pb3 Bi2 S6
compound: Tsubakihara mine, Gifu Prefecture, Japan
pub_title: The crystal structure of lillianite
formula_title: <missing>
a: 13.5350
b: 20.451
c: 4.104
alpha: 90
beta: 90
gamma: 90
cell_volume: 1136.005
crystal_density: 7.203
atoms_sites: ["PbM1", "BiM1", "PbM2", "BiM2", "PbM3", "S1", "S2", "S3", "S4"]
atoms_x: AHgFAAB4BQCwLxYAsC8WAPDEEwAgkA4AAAAAAOAeCwCQ1hsA
atoms_y: oCoIAKAqCABwBQMAcAUDAEBCDwDA1QUAAAAAAEBCDwDg8gkA
atoms_z: gIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAgIQeAICEHgCAhB4A
atoms_occupancy: gIQeAICEHgCAhB4AgIQeAAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: qDgBAKg4AQB46wAAeOsAAKhVAgCwjwEAgKsBAKBAAQDwGAEA
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:
AAAAAAAAAIQAAAAEAQEAEAABACCBAACgCAMACQAgAiCDAAOEAAC7iNIiISQHUHDQI1EYAzAYqIyEgIrA5ADMABkGAAwADUAwADAAAImORNGSGQygUA5SMAMJAwASMAQAmDADAAEAABAAAAAAAAAAAAAAAZ02VEmwoO1QMU==


formula: Pb3 Bi2 S6
compound: Synthetic
formula_title: <missing>
a: 13.540
b: 20.637
c: 4.1103
alpha: 90
beta: 90
gamma: 90
cell_volume: 1148.521
crystal_density: 7.125
atoms_sites: ["PbM1", "BiM1", "BiM2", "PbM2", "PbM3", "S1", "S2", "S3", "S4"]
atoms_x: kIgFAJCIBQCoIxYAqCMWAKjuEwDgaw4AAAAAAHg2CwAQxRsA
atoms_y: iCkIAIgpCADIAgMAyAIDAEBCDwBA0wUAAAAAAEBCDwCAEQoA
atoms_z: gIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAgIQeAICEHgCAhB4A
atoms_occupancy: gIQeAICEHgCAhB4AgIQeAAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: wNoAAMDaAAB4yAAAeMgAALBDAgDAcAEAQOcAANDPAAAA+gAA
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 anisotropic distortion of Pb3Bi2S6: a pressure-induced,
 reversible phase transition with migration of chemical bonds
 Note: P = 0.0001 GPa
 Note: occupancies not refined

qdat:
AAAAAAAAAIQAAAAEAgEAIAACAEEBAAEgEAYAIgAgCEIMAAMEAACxkqZEQkgPEPCgSRIgDjBR4U0JAI8AxAGYACIcABAAGYBAAGAAARItCqMkYSrBkBjEoAwSBgBkYBgAsEAEAAQAACAAAAAAAAAAAAAABby5yZXBgzTAxw==


formula: Pb3 Bi2 S6
compound: Synthetic
formula_title: <missing>
a: 13.353
b: 20.367
c: 4.0615
alpha: 90
beta: 90
gamma: 90
cell_volume: 1104.568
crystal_density: 7.408
atoms_sites: ["PbM1", "BiM1", "BiM2", "PbM2", "PbM3", "S1", "S2", "S3", "S4"]
atoms_x: WHUFAFh1BQCgFxYAoBcWAIARFADwZQ4AAAAAAFAdCwBQnhsA
atoms_y: sCkIALApCAAA+AIAAPgCAEBCDwDA7gUAAAAAAEBCDwDwSwoA
atoms_z: gIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAgIQeAICEHgCAhB4A
atoms_occupancy: gIQeAICEHgCAhB4AgIQeAAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: oCIBAKAiAQDQGgEA0BoBAIDnAQDA1AEA4KUBAIA4AQBAGQEA
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 anisotropic distortion of Pb3Bi2S6: a pressure-induced,
 reversible phase transition with migration of chemical bonds
 Note: P = 1.95 GPa
 Note: occupancies not refined

qdat:
AAAAAAAAAIIAAAACAICAEAAAQBBAQABIAgDABEAEAQQggABgQAAOsTJURiRAaQWNAiiRADlBJwU0JAEeAxAFYADEOAAwADMAQABAAAEWNQtjJFEqQJAcolAKGQMAGjAGAEgQAYAAgAAEAAAAAAAAAAAAAACnVrWytCg1VA==


formula: Pb3 Bi2 S6
compound: Synthetic
formula_title: <missing>
a: 13.280
b: 20.260
c: 4.0448
alpha: 90
beta: 90
gamma: 90
cell_volume: 1088.265
crystal_density: 7.519
atoms_sites: ["PbM1", "BiM1", "PbM2", "BiM2", "PbM3", "S1", "S2", "S3", "S4"]
atoms_x: QG8FAEBvBQA4ERYAOBEWADAWFADQSQ4AAAAAAMACCwAQmBsA
atoms_y: MCcIADAnCACI8gIAiPICAEBCDwBg5QUAAAAAAEBCDwBARwoA
atoms_z: gIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAgIQeAICEHgCAhB4A
atoms_occupancy: gIQeAICEHgCAhB4AgIQeAAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: ABMBAAATAQDADAEAwAwBAACpAQAAdwEA4KUBAOAoAQCAOAEA
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 anisotropic distortion of Pb3Bi2S6: a pressure-induced,
 reversible phase transition with migration of chemical bonds
 Note: P = 2.90 GPa
 Note: occupancies not refined

qdat:
AAAAAAAAAEIAAAABAIBACAAAQAggIAAkAQBgAiABAIIQYAAYEAADzEyVEYogOkNSgIokQA5QScFFCIBGgGIAxAAYhwAGAAIgGAAIAAAkxqJsqYwlSBIDlEoAwaBgAyUAQASBABAACAAAQAAAAAAAAAAAAAAKVWlTJ0JDsq==


formula: Pb3 Bi2 S6
compound: Synthetic
formula_title: <missing>
a: 13.216
b: 20.163
c: 4.03
alpha: 90
beta: 90
gamma: 90
cell_volume: 1073.891
crystal_density: 7.620
atoms_sites: ["PbM1", "BiM1", "PbM2", "BiM2", "PbM3", "S1", "S2", "S3", "S4"]
atoms_x: IGcFACBnBQA4BxYAOAcWAMAXFADQSQ4AAAAAADDoCgBgkxsA
atoms_y: WCcIAFgnCADo7AIA6OwCAEBCDwDQ/AUAAAAAAEBCDwBARwoA
atoms_z: gIQeAICEHgCAhB4AgIQeAAAAAAAAAAAAgIQeAICEHgCAhB4A
atoms_occupancy: gIQeAICEHgCAhB4AgIQeAAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: APoAAAD6AACw/gAAsP4AABCFAQAAdwEAwNQBAKAJAQBAGQEA
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 anisotropic distortion of Pb3Bi2S6: a pressure-induced,
 reversible phase transition with migration of chemical bonds
 Note: P = 3.73 GPa
 Note: occupancies not refined

qdat:
AAAAAAAAAEIAAAABAEAgBAAAIAQQEAASAIAwARAAgEEEEAAMCAAB1hJKhKSQDZDY4EOSMAOUEnBRQiARoBiAUYAGIMAAgADMAgADAAAEsahWmTKJKgJAYpFAGCQMAGRgCACQIAIAAQAACAAAAAAAAAAAAAABRp05IrRoMz==


formula: Pb3 Bi2 S6
compound: Synthetic
formula_title: <missing>
a: 11.026
b: 23.023
c: 4.0233
alpha: 90
beta: 90
gamma: 90
cell_volume: 1021.321
crystal_density: 8.012
atoms_x: IBgJACAYCQBwgBQAcIAUAMBqAgBg6gAAYOoAADCkDQAwpA0AYDwdAMBKGADgEAUAQKEUACASCgBgnA0A
atoms_y: ENABABDQAQDQlhYA0JYWAHDAGgBQ+RAAUPkQANADCQDQAwkAgM4aACDABgDQQgsAoIMOADAQFQBgIx0A
atoms_z: QEIPAEBCDwDAxi0AwMYtAEBCDwDAxi0AwMYtAMDGLQDAxi0AQEIPAEBCDwBAQg8AwMYtAEBCDwDAxi0A
atoms_occupancy: gIQeAICEHgCAhB4AgIQeAAAJPQCAhB4AgIQeAICEHgCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: APoAAAD6AACQLQEAkC0BAGAcAQDAJQEAwCUBAJD7AACQ+wAAgLsAAAASegBAGQEAYOoAAOAuAADgqwAA
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 anisotropic distortion of Pb3Bi2S6: a pressure-induced,
 reversible phase transition with migration of chemical bonds
 Note: P = 5.27 GPa
 Note: occupancies not refined
 Note: phase known as beta-Pb3Bi2S6

atoms_sites:
["PbM1", "BiM1", "PbM2", "BiM2", "PbM3", "PbM4", "BiM4", "PbM5", "BiM5", "S1", "S2", "S3", "S4", "S5", "S6"]

qdat:
AAAAAAAAAQAAAAAAAAQkAgAIAAIIAKAAUMEgIgwkIwQAIcpgmMAIjEAbwyLJALDdW5KiJQwDFAhA8aZIPNMEZINpWFQgcRRoimtoVjSMUrzKO5P7JWZZKEylhBBqYkggJ2RVSEoO3FIYJu61GECBgQDJIQggYcqiP+fpRR==


formula: Pb3 Bi2 S6
compound: Synthetic
formula_title: <missing>
a: 10.891
b: 22.638
c: 3.9926
alpha: 90
beta: 90
gamma: 90
cell_volume: 984.377
crystal_density: 8.313
atoms_x: sBkJALAZCQBwgBQAcIAUADBpAgBQ9QAAUPUAABC6DQAQug0AYDwdAKB5GADAvAUAAIIUAGC0CQCAbQ0A
atoms_y: QOEBAEDhAQAgkhYAIJIWADDTGgAA5RAAAOUQAPDtCADw7QgAkKoaAEDDBgDgHgsAEJsOAHD9FACwUB0A
atoms_z: QEIPAEBCDwDAxi0AwMYtAEBCDwDAxi0AwMYtAMDGLQDAxi0AQEIPAEBCDwBAQg8AwMYtAEBCDwDAxi0A
atoms_occupancy: gIQeAICEHgCAhB4AgIQeAAAJPQCAhB4AgIQeAICEHgCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: EO8AABDvAADgKAEA4CgBANABAQCghgEAoIYBAODdAADg3QAAQBkBACBOAADAXQAAYG0AAOAuAACAuwAA
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 anisotropic distortion of Pb3Bi2S6: a pressure-induced,
 reversible phase transition with migration of chemical bonds
 Note: P = 7.92 GPa
 Note: occupancies not refined
 Note: phase known as beta-Pb3Bi2S6

atoms_sites:
["PbM1", "BiM1", "PbM2", "BiM2", "PbM3", "PbM4", "BiM4", "PbM5", "BiM5", "S1", "S2", "S3", "S4", "S5", "S6"]

qdat:
AAAAAAAAAIAAAAAAAAERAIACAACBACgAFBAoAqGFBCCABBNEEYYAlIQDmDFMUAcM1y0mEyiQGIhBA01RY92sUbIWatGpAcQg6zlr6MpkpIvksX4vXsWSoSBLUwhA6qJIIC55X5UoGrikMEN/YwhhISEAqREEEGHTQjzy4x==


formula: Ca.487 Na.435 Pb.022 Al7.239 Fe.111 Mn.363 Li1.287 Ti.003 Si6 B3 F.709 O30.291 H3.291
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8636
b: 15.8636
c: 7.1119
alpha: 90
beta: 90
gamma: 120
cell_volume: 1549.957
crystal_density: 3.108
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L1, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "AlY", "FeY", "MnY", "LiY", "TiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAgMcDAIDHAwCAxwMAgMcDAIDHAwDY4A8AqJwLAGBfNgAAAAAAAAAAAHBbOQC4OggA+GY3ANCiBQCAZQsAGG0RAKB8EAAQKQgA

atoms_y:
AAAAAAAAAAAAAAAAgEE5AIBBOQCAQTkAgEE5AIBBOQBIIxIACLoLAKCpBgAAAAAAAAAAAJCtAwBIzjQACKIFADBmNwDA/AsAUHERAEDMDADw3zQA

atoms_z:
GIcuABiHLgAYhy4AkIYWAJCGFgCQhhYAkIYWAJCGFgBorRcAAAAAAIBAIQDQ6wwA0OsMACDAHwCQ4x0A0JI4AOBCNwDopQ0AUA44AEAMIgAAFiYA

atoms_occupancy:
YLkdAOCMGgDAVwEAIDUZACBCAgCgYgcAIC8aAKAPAAAACT0AAAk9AAAJPQAgRisA4MIRAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
kPsAAJD7AACQ+wAAkLAAAJCwAACQsAAAkLAAAJCwAABoYAAAgE0AAABkAABgdAMAYHQDADALAQBAnAAAAH0AACCAAACgcwAAcGIAADB1AABg6gAA

qdat:
AAAAAAAAAAAAAQAAEAAAAQBAAgIAAAEQARAiIAACJAIgYiQCSCgGRABIJEgIFoaEQgpCjpQMGFwwMKFWPmnChjSxJ5DrWFD0NYY34BIsQ3jWIxKFLwHIxAn9lzqPFQdFxrxAncWYiRKa5ASwUXAp8TNEmJEkSUJpAiZQQR==


formula: Ca.487 Na.435 Pb.022 Ti.003 Al7.239 Fe.111 Mn.363 Li1.287 Si6 B3 F.708 O30.291 H3.291
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8636
b: 15.8636
c: 7.1119
alpha: 90
beta: 90
gamma: 120
cell_volume: 1549.957
crystal_density: 3.108
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L1, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1d)", "O-H(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAgMcDAIDHAwCAxwMAgMcDAIDHAwDY4A8AqJwLAGBfNgB4tAAAeLQAAGDGOAC4OggA+GY3ANCiBQCAZQsAGG0RAKB8EAAQKQgA

atoms_y:
AAAAAAAAAAAAAAAAgEE5AIBBOQCAQTkAgEE5AIBBOQBIIxIACLoLAKCpBgDwaAEA8GgBAMAZAwBIzjQACKIFADBmNwDA/AsAUHERAEDMDADw3zQA

atoms_z:
GIcuABiHLgAYhy4AkIYWAJCGFgCQhhYAkIYWAJCGFgBorRcAAAAAAIBAIQCw6AwAsOgMAAC9HwCQ4x0A0JI4AOBCNwDopQ0AUA44AEAMIgAAFiYA

atoms_occupancy:
YLkdAOCMGgDAVwEAoA8AACA1GQAgQgIAoGIHACAvGgAACT0AAAk9AAAJPQCAZw4AoOsFAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
kPsAAJD7AACQ+wAAkLAAAJCwAACQsAAAkLAAAJCwAABoYAAAgE0AAABkAADQ6AAA0OgAAPCHAABAnAAAAH0AACCAAACgcwAAcGIAADB1AABg6gAA

qdat:
AAAAAAAAAAAAAQAAEAAAAQBAAgIAAAEQARAiIAACJAIgYiQCSCgGRABIJEgIFoaEQgpCjpQMGFwwMKFWPmnChjSxJ5DrWFD0NYY34BIsQ3jWIxKFLwHIxAn9lzqPFQdFxrxAncWYiRKa5ASwUXAp8TNEmJEkSUJpAiZQQR==


formula: Ca.563 Na.354 Pb.026 Al7.194 Fe.015 Mn.33 Li1.461 Si6 B3 F.694 O30.306 H3.306
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8529
b: 15.8529
c: 7.1101
alpha: 90
beta: 90
gamma: 120
cell_volume: 1547.475
crystal_density: 3.096
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L2, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAA+McDAPjHAwD4xwMA+McDAEDdDwDgmwsAKGA2AAAAAAAAAAAAMF85ANA7CABIZzcAiJ8FACBhCwB4bBEAQH0QAEDvBwA=

atoms_y:
AAAAAAAAAAAAAAAACEE5AAhBOQAIQTkACEE5AKAgEgBYugsA2KgGAAAAAAAAAAAA0KkDADDNNAC4oQUAeGk3AED6CwDIcREA6MkMAMAZNQA=

atoms_z:
YGcuAGBnLgBgZy4AMHgWADB4FgAweBYAMHgWALCrFwAAAAAAMEUhAIDwDACA8AwAcLsfAFDdHQBwiTgA8Dc3AHClDQDgCjgAOAoiAAAvJgA=

atoms_occupancy:
4FwiAECbFQBAlgEAwEoYACBOAADAtgYAYLkdAAAJPQAACT0AAAk9AMBbKgBArRIAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
UPUAAFD1AABQ9QAA0LYAANC2AADQtgAA0LYAAABkAAA4TwAAQGoAAKBhAwCgYQMA8B0BAGCfAACQfgAAYIYAAKBzAABwYgAAUHgAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgIAAAEQARAiIAACJAIgUhQCSBgGRAAoIigIFoJCQgtDTowECFwwMKFOLjnhhhyxJ5B6tCj2NIYWoAksQ3j1MRrFHYGoxAX1lyqNEoXEpqog26echROKZgTYMPAl2RskmIkiSUNogiVIIJ==


formula: Ca.563 Na.354 Pb.026 Al7.194 Fe.015 Mn.33 Li1.461 Si6 B3 F.693 O30.306 H3.306
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8529
b: 15.8529
c: 7.1101
alpha: 90
beta: 90
gamma: 120
cell_volume: 1547.475
crystal_density: 3.096
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L2, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1d)", "O-H(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAA+McDAPjHAwD4xwMA+McDAEDdDwDgmwsAKGA2AAC0AAAAtAAAgMk4ANA7CABIZzcAiJ8FACBhCwB4bBEAQH0QAEDvBwA=

atoms_y:
AAAAAAAAAAAAAAAACEE5AAhBOQAIQTkACEE5AKAgEgBYugsA2KgGAGBnAQBgZwEAEBUDADDNNAC4oQUAeGk3AED6CwDIcREA6MkMAMAZNQA=

atoms_z:
YGcuAGBnLgBgZy4AMHgWADB4FgAweBYAMHgWALCrFwAAAAAAMEUhAGDtDABg7QwAULgfAFDdHQBwiTgA8Dc3AHClDQDgCjgAOAoiAAAvJgA=

atoms_occupancy:
4FwiAECbFQBAlgEAwEoYACBOAADAtgYAYLkdAAAJPQAACT0AAAk9AGAZDgDAOQYAgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
UPUAAFD1AABQ9QAA0LYAANC2AADQtgAA0LYAAABkAAA4TwAAQGoAAMDaAADA2gAAYJ8AAGCfAACQfgAAYIYAAKBzAABwYgAAUHgAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgIAAAEQARAiIAACJAIgUhQCSBgGRAAoIigIFoJCQgtDTowECFwwMKFOLjnhhhyxJ5B6tCj2NIYWoAksQ3j1MRrFHYGoxAX1lyqNEoXEpqog26echROKZgTYMPAl2RskmIkiSUNogiVIIJ==


formula: Ca.517 Na.386 Pb.021 Ti.003 Al7.173 Fe.09 Mg.102 Mn.234 Li1.395 Si6 B3 F.589 O30.411 H3.411
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8548
b: 15.8548
c: 7.1099
alpha: 90
beta: 90
gamma: 120
cell_volume: 1547.803
crystal_density: 3.089
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L4, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MgY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAWMcDAFjHAwBYxwMAWMcDAFjHAwBYxwMA0N4PAJCbCwAIYjYAAAAAAAAAAADYXDkA8DkIAEhnNwCQoQUAkF8LAJBtEQC4fRAA8PMHAA==

atoms_y:
AAAAAAAAAAAAAAAAqEE5AKhBOQCoQTkAqEE5AKhBOQCoQTkAGCESAJC5CwD4pgYAAAAAAAAAAAAorAMAEM80ALihBQBwZzcAAPkLAOByEQCgywwAEBU1AA==

atoms_z:
YGwuAGBsLgBgbC4ACHgWAAh4FgAIeBYACHgWAAh4FgAIeBYAAKwXAAAAAACAQCEA4PkMAOD5DABQuB8AcOAdAJCMOACAOTcAcKUNADAQOACYCSIAoCUmAA==

atoms_occupancy:
II4fAECPFwAgSAEAoA8AAGDdFwDA1AEAQBMCAMDCBACgYRwAAAk9AAAJPQAACT0AIPMjAOAVGQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
0AEBANABAQDQAQEAILIAACCyAAAgsgAAILIAACCyAAAgsgAAGGUAAHhQAACAcAAAEEcDABBHAwAg/QAA0J0AACCAAACgjAAAoHMAAABkAADAdgAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgIAAAEQARAiIAACJAIgUhQCSBgGRAAoIigIFoJCQgtDTowECFwwMKFWLjnhhhyxJ5B6tGj2NIY2oAksQ3j1MRqFHYGoxAX1lymNEoXEpqog3aechROKZgTYMXAl2RskmIkiSUNogiVIIJ==


formula: Ca.517 Na.386 Pb.021 Ti.003 Al7.173 Fe.09 Mg.102 Mn.234 Li1.395 Si6 B3 F.588 O30.411 H3.411
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8548
b: 15.8548
c: 7.1099
alpha: 90
beta: 90
gamma: 120
cell_volume: 1547.803
crystal_density: 3.089
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L4, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MgY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1d)", "O-H(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAWMcDAFjHAwBYxwMAWMcDAFjHAwBYxwMA0N4PAJCbCwAIYjYAMLEAADCxAADAzzgA8DkIAEhnNwCQoQUAkF8LAJBtEQC4fRAA8PMHAA==

atoms_y:
AAAAAAAAAAAAAAAAqEE5AKhBOQCoQTkAqEE5AKhBOQCoQTkAGCESAJC5CwD4pgYAsGIBALBiAQBwHgMAEM80ALihBQBwZzcAAPkLAOByEQCgywwAEBU1AA==

atoms_z:
YGwuAGBsLgBgbC4ACHgWAAh4FgAIeBYACHgWAAh4FgAIeBYAAKwXAAAAAACAQCEAUPgMAFD4DAAwtR8AcOAdAJCMOACAOTcAcKUNADAQOACYCSIAoCUmAA==

atoms_occupancy:
II4fAECPFwAgSAEAoA8AAGDdFwDA1AEAQBMCAMDCBACgYRwAAAk9AAAJPQAACT0AgPYLAKBcCACAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
0AEBANABAQDQAQEAILIAACCyAAAgsgAAILIAACCyAAAgsgAAGGUAAHhQAACAcAAAAOEAAADhAACAiQAA0J0AACCAAACgjAAAoHMAAABkAADAdgAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgIAAAEQARAiIAACJAIgUhQCSBgGRAAoIigIFoJCQgtDTowECFwwMKFWLjnhhhyxJ5B6tGj2NIY2oAksQ3j1MRqFHYGoxAX1lymNEoXEpqog3aechROKZgTYMXAl2RskmIkiSUNogiVIIJ==


formula: Ca.628 Na.297 Pb.023 Al7.188 Fe.021 Mn.207 Li1.584 Si6 B3 F.702 O30.298 H3.298
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8456
b: 15.8456
c: 7.1066
alpha: 90
beta: 90
gamma: 120
cell_volume: 1545.289
crystal_density: 3.084
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L5, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAgMcDAIDHAwCAxwMAgMcDAOjaDwConAsAuGE2AAAAAAAAAAAAUF05APA5CACIaDcAKKAFAIBgCwDoahEAYHsQABAQCAA=

atoms_y:
AAAAAAAAAAAAAAAAgEE5AIBBOQCAQTkAgEE5ADgfEgBYugsASKcGAAAAAAAAAAAAsKsDABDPNAB4oAUA2Gg3APD0CwAIcxEA4MwMAPD4NAA=

atoms_z:
uGQuALhkLgC4ZC4AKGIWAChiFgAoYhYAKGIWABitFwAAAAAAYD0hABDyDAAQ8gwA4LkfAHDgHQDwfDgAkC43AAikDQAgDDgAYAoiAGAGJgA=

atoms_occupancy:
gFQmAKAgEgBgZwEAgCsYAGBtAAAgNgQAADogAAAJPQAACT0AAAk9AMDYKgBAMBIAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
cN8AAHDfAABw3wAA0LYAANC2AADQtgAA0LYAAIhjAADYTwAAMHUAAPBcAwDwXAMA8AQBAICiAADwhwAAIIAAAPBuAAAAZAAAMHUAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQARAiIAACIgIgUhQCSBgGRAAoIigMFoNCQgtDSowEDE4oMKHNLjXhhhqRJph6tCjuHIId8AksY+h1MYrCl4HoYgX/UqnFCoXio1ogSubMhRNNZgLYMNgVeJmiSIkyRKG0gSVIIJ==


formula: Ca.628 Na.297 Pb.023 Al7.188 Fe.021 Mn.207 Li1.584 Si6 B3 F.702 O32.97 H5.97
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8456
b: 15.8456
c: 7.1066
alpha: 90
beta: 90
gamma: 120
cell_volume: 1545.289
crystal_density: 3.230
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L5, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1d)", "O-H(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAgMcDAIDHAwCAxwMAgMcDAOjaDwConAsAuGE2AICxAACAsQAAEMs4APA5CACIaDcAKKAFAIBgCwDoahEAYHsQABAQCAA=

atoms_y:
AAAAAAAAAAAAAAAAgEE5AIBBOQCAQTkAgEE5ADgfEgBYugsASKcGALBiAQCwYgEAUBsDABDPNAB4oAUA2Gg3APD0CwAIcxEA4MwMAPD4NAA=

atoms_z:
uGQuALhkLgC4ZC4AKGIWAChiFgAoYhYAKGIWABitFwAAAAAAYD0hAPDuDADw7gwAwLYfAHDgHQDwfDgAkC43AAikDQAgDDgAYAoiAGAGJgA=

atoms_occupancy:
gFQmAKAgEgBgZwEAgCsYAGBtAAAgNgQAADogAAAJPQAACT0AAAk9AEBIDgDAbDwAgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
cN8AAHDfAABw3wAA0LYAANC2AADQtgAA0LYAAIhjAADYTwAAMHUAAPDrAADw6wAAgIkAAICiAADwhwAAIIAAAPBuAAAAZAAAMHUAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQARAiIAACIgIgUhQCSBgGRAAoIigMFoNCQgtDSowEDE4oMKHNLjXhhhqRJph6tCjuHIId8AksY+h1MYrCl4HoYgX/UqnFCoXio1ogSubMhRNNZgLYMNgVeJmiSIkyRKG0gSVIIJ==


formula: Ca.641 Na.288 Pb.023 Al7.194 Fe.021 Mn.18 Li1.605 Si6 B3 F.696 O30.304 H3.304
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8418
b: 15.8418
c: 7.1044
alpha: 90
beta: 90
gamma: 120
cell_volume: 1544.070
crystal_density: 3.083
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L6, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAA4MYDAODGAwDgxgMA4MYDACDaDwBYnAsAgGI2AAAAAAAAAAAA8F05AEg8CABgaDcAEJ8FAEBfCwBwahEAwHoQAKD4BwA=

atoms_y:
AAAAAAAAAAAAAAAAIEI5ACBCOQAgQjkAIEI5AHAeEgDguQsAgKYGAAAAAAAAAAAAEKsDALjMNACgoAUA8Gk3AAj2CwAgdBEAaMwMAGAQNQA=

atoms_z:
YGcuAGBnLgBgZy4AIFYWACBWFgAgVhYAIFYWAKiuFwAAAAAA8D4hALDoDACw6AwA4LkfALDmHQCAfjgAIDA3AIimDQCIDTgA0A0iAMD2JQA=

atoms_occupancy:
oB8nAACUEQBgZwEAwEoYAGBtAACAqQMAYKcgAAAJPQAACT0AAAk9AAB7KgAAjhIAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
kOIAAJDiAACQ4gAAwMEAAMDBAADAwQAAwMEAAOhiAAAgTgAAQGoAAMBLAwDASwMAMAsBAPCgAABAgwAA0IQAAPBuAAAAZAAAwHYAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMFkNCQgdDSowEDC4oGKHNLjXhhxqZIth5tCj+GoMb8AkkI9xzMY5Cl4DkYgV+y5lHioNi414gTuPKhRNFcwJ0KLgTdI2STIUyRKG0QSTIEE==


formula: Ca.641 Na.288 Pb.023 Al7.194 Fe.021 Mn.18 Li1.605 Si6 B3 F.696 O30.303 H3.303
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8418
b: 15.8418
c: 7.1044
alpha: 90
beta: 90
gamma: 120
cell_volume: 1544.070
crystal_density: 3.083
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L6, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1d)", "O-H(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAA4MYDAODGAwDgxgMA4MYDACDaDwBYnAsAgGI2AECwAABAsAAAoMw4AEg8CABgaDcAEJ8FAEBfCwBwahEAwHoQAKD4BwA=

atoms_y:
AAAAAAAAAAAAAAAAIEI5ACBCOQAgQjkAIEI5AHAeEgDguQsAgKYGACBhAQAgYQEAUBsDALjMNACgoAUA8Gk3AAj2CwAgdBEAaMwMAGAQNQA=

atoms_z:
YGcuAGBnLgBgZy4AIFYWACBWFgAgVhYAIFYWAKiuFwAAAAAA8D4hACDnDAAg5wwAwLYfALDmHQCAfjgAIDA3AIimDQCIDTgA0A0iAMD2JQA=

atoms_occupancy:
oB8nAACUEQBgZwEAwEoYAGBtAACAqQMAYKcgAAAJPQAACT0AAAk9AAApDgAgKgYAgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
kOIAAJDiAACQ4gAAwMEAAMDBAADAwQAAwMEAAOhiAAAgTgAAQGoAAJDiAACQ4gAAwI8AAPCgAABAgwAA0IQAAPBuAAAAZAAAwHYAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMFkNCQgdDSowEDC4oGKHNLjXhhxqZIth5tCj+GoMb8AkkI9xzMY5Cl4DkYgV+y5lHioNi414gTuPKhRNFcwJ0KLgTdI2STIUyRKG0QSTIEE==


formula: Ca.636 Na.282 Pb.02 Ti.003 Al7.224 Fe.045 Mg.003 Mn.135 Li1.593 Si6 B3 F.709 O30.291 H3.291
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8363
b: 15.8363
c: 7.1040
alpha: 90
beta: 90
gamma: 120
cell_volume: 1542.911
crystal_density: 3.082
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L7, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MgY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAaMYDAGjGAwBoxgMAaMYDAGjGAwBoxgMASNoPAGibCwA4ZDYAAAAAAAAAAACoXzkA4DoIAFBpNwD4nQUAWFsLAIhrEQAgehAAcM4HAA==

atoms_y:
AAAAAAAAAAAAAAAAmEI5AJhCOQCYQjkAmEI5AJhCOQCYQjkA+B0SAJC5CwDIpAYAAAAAAAAAAABYqQMAIM40ALCfBQAIazcAaPULACB0EQD4yAwAkDo1AA==

atoms_z:
6GsuAOhrLgDoay4A2FIWANhSFgDYUhYA2FIWANhSFgDYUhYAqK4XAAAAAABAOiEAYO0MAGDtDABwux8AAOIdABCAOAAgMDcASKUNAJgMOAB4CyIAgNclAA==

atoms_occupancy:
gNEmAEA2EQCAOAEAoA8AAADnGABg6gAAoA8AACC/AgDgaCAAAAk9AAAJPQAACT0AIEYrAODCEQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
AOEAAADhAAAA4QAAkLAAAJCwAACQsAAAkLAAAJCwAACQsAAAAGQAAPBQAADQawAAoC8DAKAvAwAQCAEAgKIAANCEAABAgwAA8G4AAJBlAACgcwAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMDkNCQgdDSkwGDC4oGKHNHjThhxqYk9h5tCj+GsMb8AimIbxyqY5Cl4DUYgV+y5lHioNi414gTuPKgxLFcwJ0KHgS9I2STIUaRGG0QSSoEE==


formula: Ca.636 Na.282 Pb.02 Ti.003 Al7.224 Fe.045 Mg.003 Mn.135 Li1.593 Si6 B3 F.708 O30.291 H3.291
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8363
b: 15.8363
c: 7.1040
alpha: 90
beta: 90
gamma: 120
cell_volume: 1542.911
crystal_density: 3.082
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L7, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MgY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1d)", "O-H(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAaMYDAGjGAwBoxgMAaMYDAGjGAwBoxgMASNoPAGibCwA4ZDYAmK0AAJitAABQ0TgA4DoIAFBpNwD4nQUAWFsLAIhrEQAgehAAcM4HAA==

atoms_y:
AAAAAAAAAAAAAAAAmEI5AJhCOQCYQjkAmEI5AJhCOQCYQjkA+B0SAJC5CwDIpAYA4FoBAOBaAQDgHAMAIM40ALCfBQAIazcAaPULACB0EQD4yAwAkDo1AA==

atoms_z:
6GsuAOhrLgDoay4A2FIWANhSFgDYUhYA2FIWANhSFgDYUhYAqK4XAAAAAABAOiEA0OsMANDrDABQuB8AAOIdABCAOAAgMDcASKUNAJgMOAB4CyIAgNclAA==

atoms_occupancy:
gNEmAEA2EQCAOAEAoA8AAADnGABg6gAAoA8AACC/AgDgaCAAAAk9AAAJPQAACT0AgGcOAKDrBQCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
AOEAAADhAAAA4QAAkLAAAJCwAACQsAAAkLAAAJCwAACQsAAAAGQAAPBQAADQawAAwNoAAMDaAABwlAAAgKIAANCEAABAgwAA8G4AAJBlAACgcwAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMDkNCQgdDSkwGDC4oGKHNHjThhxqYk9h5tCj+GsMb8AimIbxyqY5Cl4DUYgV+y5lHioNi414gTuPKgxLFcwJ0KHgS9I2STIUaRGG0QSSoEE==


formula: Ca.441 Na.471 Pb.025 Al7.167 Fe.027 Mn.531 Li1.278 Si6 B3 F.681 O30.319 H3.319
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8675
b: 15.8675
c: 7.1135
alpha: 90
beta: 90
gamma: 120
cell_volume: 1551.068
crystal_density: 3.112
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L11, ordered model

atoms_x:
AAAAAAAAAAAAAAAAwMgDAMDIAwDAyAMAwMgDAJDiDwAInAsAuFw2AAAAAAAAAAAAQFk5AAA+CAB4ZDcAYKQFAPBoCwBQbBEAaH0QAPAMCAA=

atoms_y:
AAAAAAAAAAAAAAAAQEA5AEBAOQBAQDkAQEA5AAAlEgAwugsASKwGAAAAAAAAAAAAwK8DAADLNACIpAUAoGQ3AGj/CwBIbxEAMM0MABD8NAA=

atoms_z:
8GguAPBoLgDwaC4A4JoWAOCaFgDgmhYA4JoWAMinFwAAAAAAMEUhACDnDAAg5wwAEMsfAODeHQBAkTgAUEE3APikDQB4CTgAyAYiAGAGJgA=

atoms_occupancy:
oOoaAGC/HACghgEAIL4XAKCMAACgzQoAQAAaAAAJPQAACT0AAAk9AKCQKQBgeBMAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
UA4BAFAOAQBQDgEAwKgAAMCoAADAqAAAwKgAAChfAAAITQAA0GsAAEC8AwBAvAMAQBkBADCOAADgeQAAkH4AABByAADgYAAAwHYAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAAEAAAAQBAAgIAAAEQARAiIAAEJAIgYiQCSCgGhABIJEgIFoaEQgqGlpQMGFxwMSGWOmnChjUxJ5DzaFH8NYQ34BIsQ7jmIxKFLwHQzAr+lzKPFQdFxrxAncWZCiOSxAWwYWAp8TNEqJIkiUZJAmZQQR==


formula: Ca.441 Na.471 Pb.025 Al7.167 Fe.027 Mn.531 Li1.278 Si6 B3 F.681 O30.318 H3.318
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8675
b: 15.8675
c: 7.1135
alpha: 90
beta: 90
gamma: 120
cell_volume: 1551.068
crystal_density: 3.112
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L11, disordered model

atoms_x:
AAAAAAAAAAAAAAAAwMgDAMDIAwDAyAMAwMgDAJDiDwAInAsAuFw2ALC9AACwvQAAIMA4AAA+CAB4ZDcAYKQFAPBoCwBQbBEAaH0QAPAMCAA=

atoms_y:
AAAAAAAAAAAAAAAAQEA5AEBAOQBAQDkAQEA5AAAlEgAwugsASKwGALB7AQCwewEAMBgDAADLNACIpAUAoGQ3AGj/CwBIbxEAMM0MABD8NAA=

atoms_z:
8GguAPBoLgDwaC4A4JoWAOCaFgDgmhYA4JoWAMinFwAAAAAAMEUhAADkDAAA5AwA8McfAODeHQBAkTgAUEE3APikDQB4CTgAyAYiAGAGJgA=

atoms_occupancy:
oOoaAGC/HACghgEAIL4XAKCMAACgzQoAQAAaAAAJPQAACT0AAAk9AODaDQBAeAYAgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
UA4BAFAOAQBQDgEAwKgAAMCoAADAqAAAwKgAAChfAAAITQAA0GsAAMDaAADA2gAAoIwAADCOAADgeQAAkH4AABByAADgYAAAwHYAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAAEAAAAQBAAgIAAAEQARAiIAAEJAIgYiQCSCgGhABIJEgIFoaEQgqGlpQMGFxwMSGWOmnChjUxJ5DzaFH8NYQ34BIsQ7jmIxKFLwHQzAr+lzKPFQdFxrxAncWYCiOSxAWwYWAp8TNEqJIkiUZJAmZQQR==


formula: Ca.51 Na.408 Pb.026 Al7.191 Fe.027 Mn.423 Li1.359 Si6 B3 F.752 O30.248 H3.248
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.853
b: 15.853
c: 7.120
alpha: 90
beta: 90
gamma: 120
cell_volume: 1549.650
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
pub_title:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L12, ordered model

atoms_x:
AAAAAAAAAAAAAAAAgMcDAIDHAwCAxwMAgMcDAOjfDwDgmwsAQGE2AAAAAAAAAAAAOFw5ACA8CABYZjcAuKEFANBlCwAYbREAQH0QAHAACAA=

atoms_y:
AAAAAAAAAAAAAAAAgEE5AIBBOQCAQTkAgEE5AAgiEgDguQsAwKcGAAAAAAAAAAAAyKwDAODMNACoogUASGc3ALD9CwB4cREAGMwMAJAINQA=

atoms_z:
WGUuAFhlLgBYZS4A4IsWAOCLFgDgixYA4IsWAHCqFwAAAAAA4EkhAJDlDACQ5QwAsMEfAODeHQBAkTgAMD43ANCkDQCACzgAYAoiAAAWJgA=

atoms_occupancy:
wCAfAADnGABAlgEAIDsYAKCMAAAgmwgAIKYbAAAJPQAACT0AAAk9AADmLQAAIw8AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
oPoAAKD6AACg+gAAsLMAALCzAACwswAAsLMAAAhmAADwUAAA0GsAANBZAwDQWQMAABMBAGCfAADQhAAAgIkAABByAAAAZAAAIIAAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAAEAAAAQBAAgIAAAIQARAiIAACJAIgYhgCSCgGRAAoIigIFoZEQgtGTowMGFwwUSFOOlnChByxR5DTVEj0OYQ7oAlMR7ltYxyJN4HIzBH6pVqWJglFRzRBd0c5DCeczAmwYmBJsTJEsRZokkbRBEqQgT==


formula: Ca.51 Na.408 Pb.026 Al7.191 Fe.027 Mn.423 Li1.359 Si6 B3 F.753 O30.246 H3.246
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.853
b: 15.853
c: 7.120
alpha: 90
beta: 90
gamma: 120
cell_volume: 1549.650
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
pub_title:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L12, disordered model

atoms_x:
AAAAAAAAAAAAAAAAgMcDAIDHAwCAxwMAgMcDAOjfDwDgmwsAQGE2AAi2AAAItgAAQMM4ACA8CABYZjcAuKEFANBlCwAYbREAQH0QAHAACAA=

atoms_y:
AAAAAAAAAAAAAAAAgEE5AIBBOQCAQTkAgEE5AAgiEgDguQsAwKcGABBsAQAQbAEAEBUDAODMNACoogUASGc3ALD9CwB4cREAGMwMAJAINQA=

atoms_z:
WGUuAFhlLgBYZS4A4IsWAOCLFgDgixYA4IsWAHCqFwAAAAAA4EkhAHDiDABw4gwAIMAfAODeHQBAkTgAMD43ANCkDQCACzgAYAoiAAAWJgA=

atoms_occupancy:
wCAfAADnGABAlgEAIDsYAKCMAAAgmwgAIKYbAAAJPQAACT0AAAk9AOBRDwBAAQUAgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
oPoAAKD6AACg+gAAsLMAALCzAACwswAAsLMAAAhmAADwUAAA0GsAAIC7AACAuwAAgIkAAGCfAADQhAAAgIkAABByAAAAZAAAIIAAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAAEAAAAQBAAgIAAAIQARAiIAACJAIgYhgCSCgGRAAoIigIFoZEQgtGTowMGFwwUSFOOlnChByxR5DTVEj0OYQ7oAlMR7ltYxyJN4HIzBH6pVqWJglFRzRBd0c5DCeczAmwYmBJsTJEsRZokkbRBEqQgT==


formula: Ca.583 Na.345 Pb.006 Ti.009 Al7.209 Fe.015 Mg.06 Mn.033 Li1.491 Si6 B3 F.647 O30.353 H3.353
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8449
b: 15.8449
c: 7.1053
alpha: 90
beta: 90
gamma: 120
cell_volume: 1544.870
crystal_density: 3.045
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L13, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MgY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAIMgDACDIAwAgyAMAIMgDACDIAwAgyAMAENsPALibCwAQXzYAAAAAAAAAAABgXDkA0DYIAAhmNwB4oAUAgGALAPhpEQAAfBAAACAIAA==

atoms_y:
AAAAAAAAAAAAAAAA4EA5AOBAOQDgQDkA4EA5AOBAOQDgQDkAeCASAOC5CwDwqQYAAAAAAAAAAACgrAMAMNI0APiiBQCIaDcAaPULAPBxEQAwzQwAwOc0AA==

atoms_z:
GIcuABiHLgAYhy4AMFUWADBVFgAwVRYAMFUWADBVFgAwVRYAULEXAAAAAACgQyEAIAANACAADQDwrh8AQOgdAPB8OACwMTcACKkNAFgQOABwEyIAoCUmAA==

atoms_occupancy:
YJUjAKAOFQDAXQAA4C4AAOCYGAAgTgAAgDgBAOCrAACgVR4AAAk9AAAJPQAACT0AYH0nAKCLFQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
kPsAAJD7AACQ+wAA4KsAAOCrAADgqwAA4KsAAOCrAADgqwAAmGIAADhUAAAQcgAAIFUDACBVAwDwBAEAQJwAANCEAADQhAAAEHIAAHBiAADAdgAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQARAiIAACIgEgUhQCSBgGRAAoIigMFoNCQgtDSowEDE4oEKHNLjXhhxqRJph6tCj+GoIb8AkkI+h3MYrCl4DkYgV/U5lFioXio14gSuLMhRNNdgJ0KLgVeJ2iTIkyRKG0gSVIIE==


formula: Ca.583 Na.345 Pb.006 Ti.009 Al7.209 Fe.015 Mg.06 Mn.033 Li1.491 Si6 B3 F.648 O30.351 H3.351
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8449
b: 15.8449
c: 7.1053
alpha: 90
beta: 90
gamma: 120
cell_volume: 1544.870
crystal_density: 3.045
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L13, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MgY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1d)", "O-H(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAIMgDACDIAwAgyAMAIMgDACDIAwAgyAMAENsPALibCwAQXzYAOK4AADiuAACgzDgA0DYIAAhmNwB4oAUAgGALAPhpEQAAfBAAACAIAA==

atoms_y:
AAAAAAAAAAAAAAAA4EA5AOBAOQDgQDkA4EA5AOBAOQDgQDkAeCASAOC5CwDwqQYAcFwBAHBcAQBwHgMAMNI0APiiBQCIaDcAaPULAPBxEQAwzQwAwOc0AA==

atoms_z:
GIcuABiHLgAYhy4AMFUWADBVFgAwVRYAMFUWADBVFgAwVRYAULEXAAAAAACgQyEAAP0MAAD9DABgrR8AQOgdAPB8OACwMTcACKkNAFgQOABwEyIAoCUmAA==

atoms_occupancy:
YJUjAKAOFQDAXQAA4C4AAOCYGAAgTgAAgDgBAOCrAACgVR4AAAk9AAAJPQAACT0AAC8NACAkBwCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
kPsAAJD7AACQ+wAA4KsAAOCrAADgqwAA4KsAAOCrAADgqwAAmGIAADhUAAAQcgAA4PYAAOD2AACgjAAAQJwAANCEAADQhAAAEHIAAHBiAADAdgAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQARAiIAACIgEgUhQCSBgGRAAoIigMFoNCQgtDSowEDE4oEKHNLjXhhxqRJph6tCj+GoIb8AkkI+h3MYrCl4DkYgV/U5lFioXio14gSuLMhRNNdgJ0KLgVeJ2iTIkyRKG0gSVIIE==


formula: Ca.696 Na.228 Pb.01 Al7.257 Fe.03 Mn.033 Li1.68 Si6 B3 F.668 O30.332 H3.332
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8248
b: 15.8248
c: 7.0993
alpha: 90
beta: 90
gamma: 120
cell_volume: 1539.652
crystal_density: 3.069
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L15, ordered model

atoms_x:
AAAAAAAAAAAAAAAA8MUDAPDFAwDwxQMA8MUDAKDXDwDgmwsAmGM2AAAAAAAAAAAAmGA5AOg3CAAoaTcAQJwFAPhWCwCQaBEAMHkQAIByCAA=

atoms_y:
AAAAAAAAAAAAAAAAEEM5ABBDOQAQQzkAEEM5APAbEgCQuQsAaKUGAAAAAAAAAAAAaKgDABjRNADYnwUAwGw3AKjsCwDwcREAOMoMAICWNAA=

atoms_z:
yHcuAMh3LgDIdy4A0DIWANAyFgDQMhYA0DIWANCzFwAAAAAAYD0hAEDqDABA6gwAQKofAGDrHQAAcjgAIDA3ABChDQCAEDgAUBAiAKAlJgA=

atoms_occupancy:
AHsqAIDqDQBAnAAA4JIZAECcAADgqwAAAC4iAAAJPQAACT0AAAk9AIDFKACAQxQAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
YNEAAGDRAABg0QAAkLAAAJCwAACQsAAAkLAAAABfAACITwAAsGgAAKAvAwCgLwMAQAABABCkAABAgwAAcHsAAIBwAABwYgAAwHYAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQghEAACIgEgUhQCJBgFQgAkEiQEC0NCIwUhS0oGDC44GJCnHxTgwwpYk8hprCR3GsEa8ASWIbx6mMViTcBUIgT6yVTmiULhUU0QbXHNQwmkuwEyFFwKvE7RKkKaJFCSQJJkEC==


formula: Ca.696 Na.228 Pb.01 Al7.257 Fe.03 Mn.033 Li1.68 Si6 B3 F.666 O30.333 H3.333
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8248
b: 15.8248
c: 7.0993
alpha: 90
beta: 90
gamma: 120
cell_volume: 1539.652
crystal_density: 3.069
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L15, disordered model

atoms_x:
AAAAAAAAAAAAAAAA8MUDAPDFAwDwxQMA8MUDAKDXDwDgmwsAmGM2AHiqAAB4qgAAyMw4AOg3CAAoaTcAQJwFAPhWCwCQaBEAMHkQAIByCAA=

atoms_y:
AAAAAAAAAAAAAAAAEEM5ABBDOQAQQzkAEEM5APAbEgCQuQsAaKUGAKBUAQCgVAEAoBYDABjRNADYnwUAwGw3AKjsCwDwcREAOMoMAICWNAA=

atoms_z:
yHcuAMh3LgDIdy4A0DIWANAyFgDQMhYA0DIWANCzFwAAAAAAYD0hACDnDAAg5wwAQKofAGDrHQAAcjgAIDA3ABChDQCAEDgAUBAiAKAlJgA=

atoms_occupancy:
AHsqAIDqDQBAnAAA4JIZAECcAADgqwAAAC4iAAAJPQAACT0AAAk9AMCMDQBgxgYAgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
YNEAAGDRAABg0QAAkLAAAJCwAACQsAAAkLAAAABfAACITwAAsGgAAEDnAABA5wAAIIAAABCkAABAgwAAcHsAAIBwAABwYgAAwHYAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQghEAACIgEgUhQCJBgFQgAkEiQEC0NCIwUhS0oGDC44GJCnHxTgwwpYk8hprCR3GsEa8ASWIbx6mMViTcBUIgT6yVTmiULhUU0QbXHNQwmkuwEyFFwKvE7RKkKaJFCSQJJkEC==


formula: Ca.685 Na.245 Pb.01 Ti.003 Al7.287 Fe.06 Mn.036 Li1.617 Si6 B3 F.685 O30.315 H3.315
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8307
b: 15.8307
c: 7.1013
alpha: 90
beta: 90
gamma: 120
cell_volume: 1541.234
crystal_density: 3.073
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L16, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAQMYDAEDGAwBAxgMAQMYDAEDGAwAY2A8AkJsLAPBlNgAAAAAAAAAAAKBiOQBwNwgAGGo3ADCdBQA4WAsAOGsRADB5EABQFggA

atoms_y:
AAAAAAAAAAAAAAAAwEI5AMBCOQDAQjkAwEI5AMBCOQAYHBIA8LgLABCjBgAAAAAAAAAAAGCmAwCQ0TQA6J4FANBrNwCo8QsAmHQRACDJDACw8jQA

atoms_z:
6HUuAOh1LgDodS4ASD0WAEg9FgBIPRYASD0WAEg9FgBoshcAAAAAAPA+IQDQ6wwA0OsMAFC4HwB45x0AkHg4ANAqNwBwpQ0A2A04ABgRIgAAFiYA

atoms_occupancy:
IM8pACD0DgBAnAAAoA8AACAvGgCAOAEAgLsAAODlIAAACT0AAAk9AAAJPQAgzykA4DkTAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
4N0AAODdAADg3QAA8KAAAPCgAADwoAAA8KAAAPCgAAAAXwAACE0AAEBqAADAAAMAwAADAEAAAQAwpwAAQIMAALCBAAAwcAAAEF4AANhyAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCSBgFQgAkIiQECkNCQwUjS0wGDC4oGJHPHxTgwwpYk9hptCh9GsMbsAiWIbxymUVil8DUIgT6y9THioLi4VUQbuPKgxGk8wF0KGwKtEzRLEWaJFCSQRKoEE==


formula: Ca.685 Na.245 Pb.01 Ti.003 Al7.287 Fe.06 Mn.036 Li1.617 Si6 B3 F.684 O30.315 H3.315
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8307
b: 15.8307
c: 7.1013
alpha: 90
beta: 90
gamma: 120
cell_volume: 1541.234
crystal_density: 3.073
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L16, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1d)", "O-H(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAQMYDAEDGAwBAxgMAQMYDAEDGAwAY2A8AkJsLAPBlNgCIqQAAiKkAABjXOABwNwgAGGo3ADCdBQA4WAsAOGsRADB5EABQFggA

atoms_y:
AAAAAAAAAAAAAAAAwEI5AMBCOQDAQjkAwEI5AMBCOQAYHBIA8LgLABCjBgAQUwEAEFMBAGgcAwCQ0TQA6J4FANBrNwCo8QsAmHQRACDJDACw8jQA

atoms_z:
6HUuAOh1LgDodS4ASD0WAEg9FgBIPRYASD0WAEg9FgBoshcAAAAAAPA+IQCw6AwAsOgMAKCzHwB45x0AkHg4ANAqNwBwpQ0A2A04ABgRIgAAFiYA

atoms_occupancy:
IM8pACD0DgBAnAAAoA8AACAvGgCAOAEAgLsAAODlIAAACT0AAAk9AAAJPQCA6g0AoGgGAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
4N0AAODdAADg3QAA8KAAAPCgAADwoAAA8KAAAPCgAAAAXwAACE0AAEBqAACwzAAAsMwAAFCRAAAwpwAAQIMAALCBAAAwcAAAEF4AANhyAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCSBgFQgAkIiQECkNCQwUjS0wGDC4oGJHPHxTgwwpYk9hptCh9GsMbsAiWIbxymUVil8DUIgT6y9THioLi4VUQbuPKgxGk8wF0KGwKtEzRLEWaJFCSQRKoEE==


formula: Ca.645 Na.282 Pb.009 Ti.006 Al7.296 Fe.009 Mn.03 Li1.557 Si6 B3 F.714 O30.286 H3.286
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8337
b: 15.8337
c: 7.1023
alpha: 90
beta: 90
gamma: 120
cell_volume: 1542.036
crystal_density: 3.058
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L17, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAGMYDABjGAwAYxgMAGMYDABjGAwAI2Q8A4JsLAABlNgAAAAAAAAAAAHBgOQBINwgAKGk3AFidBQAIWwsAEGsRAJB4EACADggA

atoms_y:
AAAAAAAAAAAAAAAA6EI5AOhCOQDoQjkA6EI5AOhCOQAwHRIAuLkLAACkBgAAAAAAAAAAAJCoAwC40TQA2J8FAKhrNwDA8gsA0HMRAMDJDACA+jQA

atoms_z:
GH0uABh9LgAYfS4AkEAWAJBAFgCQQBYAkEAWAJBAFgDIsRcAAAAAAEA6IQAQ8gwAEPIMANCrHwCw5h0A0Hk4AHArNwAApw0A2A04ACAOIgDA9iUA

atoms_occupancy:
IF4nAEA2EQCgjAAAQB8AAABeGgDgLgAAQJwAAGCtHwAACT0AAAk9AAAJPQBAlCsAwHQRAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
QOcAAEDnAABA5wAA4KsAAOCrAADgqwAA4KsAAOCrAABAYAAA0FIAAPBuAAAQLgMAEC4DACD9AACgpQAAQIMAAICJAACAcAAA8F8AAKBzAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgFRAAkIiQECkNCQwcjS0wGDC4oGJHPHjThhwqYk9h5tCj9GsMb8AimIbxymY1il8DUYgT6y5THioNi4V4QbuPKgxHlcwJ0KHgK9E1RLEWaRGCSQTKoEE==


formula: Ca.645 Na.282 Pb.009 Ti.006 Al7.296 Fe.009 Mn.03 Li1.557 Si6 B3 F.714 O30.285 H3.285
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8337
b: 15.8337
c: 7.1023
alpha: 90
beta: 90
gamma: 120
cell_volume: 1542.036
crystal_density: 3.058
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L17, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1d)", "O-H(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAGMYDABjGAwAYxgMAGMYDABjGAwAI2Q8A4JsLAABlNgAgrQAAIK0AAHDUOABINwgAKGk3AFidBQAIWwsAEGsRAJB4EACADggA

atoms_y:
AAAAAAAAAAAAAAAA6EI5AOhCOQDoQjkA6EI5AOhCOQAwHRIAuLkLAACkBgDgWgEA4FoBAHAeAwC40TQA2J8FAKhrNwDA8gsA0HMRAMDJDACA+jQA

atoms_z:
GH0uABh9LgAYfS4AkEAWAJBAFgCQQBYAkEAWAJBAFgDIsRcAAAAAAEA6IQCA8AwAgPAMALCoHwCw5h0A0Hk4AHArNwAApw0A2A04ACAOIgDA9iUA

atoms_occupancy:
IF4nAEA2EQCgjAAAQB8AAABeGgDgLgAAQJwAAGCtHwAACT0AAAk9AAAJPQDAhg4AYMwFAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
QOcAAEDnAABA5wAA4KsAAOCrAADgqwAA4KsAAOCrAABAYAAA0FIAAPBuAABg6gAAYOoAADCOAACgpQAAQIMAAICJAACAcAAA8F8AAKBzAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgFRAAkIiQECkNCQwcjS0wGDC4oGJHPHjThhwqYk9h5tCj9GsMb8AimIbxymY1il8DUYgT6y5THioNi4V4QbuPKgxHlcwJ0KHgK9E1RLEWaRGCSQTKoEE==


formula: Ca.688 Na.239 Pb.009 Ti.003 Al7.335 Fe.03 Mn.033 Li1.596 Si6 B3 F.73 O30.27 H3.27
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8293
b: 15.8293
c: 7.1003
alpha: 90
beta: 90
gamma: 120
cell_volume: 1540.745
crystal_density: 3.071
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L18, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "F(1o)", "O-H(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAA8MUDAPDFAwDwxQMA8MUDAPDFAwDI1w8AkJsLAHhlNgAAAAAAAAAAANhhOQBANQgAGGo3AAidBQDwWQsAeGwRAIB5EADg5QcA

atoms_y:
AAAAAAAAAAAAAAAAEEM5ABBDOQAQQzkAEEM5ABBDOQDwGxIAuLkLAIijBgAAAAAAAAAAACinAwDA0zQA6J4FAPhrNwAI8QsAUHYRAHDJDAAgIzUA

atoms_z:
cHUuAHB1LgBwdS4AMDIWADAyFgAwMhYAMDIWADAyFgDIsRcAAAAAAEA6IQDg4AwA4OAMABCyHwCw5h0AQHg4AFAoNwDIpw0AGA84AIgPIgAAFiYA

atoms_occupancy:
AP4pAGCWDgCgjAAAoA8AACApGwBAnAAA4KsAAIB4IAAACT0AAAk9AAAJPQBAjiwAwHoQAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
wNoAAMDaAADA2gAA4KsAAOCrAADgqwAA4KsAAOCrAADQYQAAgFIAANBrAAAg8QIAIPECAJD7AABwrQAAsIEAANCEAAAwdQAAaGAAAKBzAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCJBgFQgAkIiQECkNCIwUhS0wGDC4oGJDPHxTgwwpYk8hprCh3GsMbsASWIbx6mUVil8DUIgTqyVTGiYLiUVUQbeNOgwmk8wFyGFwKvEzRLESaJFCSQJJoEC==


formula: Ca.688 Na.239 Pb.009 Ti.003 Al7.335 Fe.03 Mn.033 Li1.596 Si6 B3 F.729 O30.27 H3.27
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8293
b: 15.8293
c: 7.1003
alpha: 90
beta: 90
gamma: 120
cell_volume: 1540.745
crystal_density: 3.071
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L18, disordered model

atoms_x:
AAAAAAAAAAAAAAAA8MUDAPDFAwDwxQMA8MUDAPDFAwDI1w8AkJsLAHhlNgCopwAAqKcAAJDXOABANQgAGGo3AAidBQDwWQsAeGwRAIB5EADg5QcA

atoms_y:
AAAAAAAAAAAAAAAAEEM5ABBDOQAQQzkAEEM5ABBDOQDwGxIAuLkLAIijBgDwTwEA8E8BAHAeAwDA0zQA6J4FAPhrNwAI8QsAUHYRAHDJDAAgIzUA

atoms_z:
cHUuAHB1LgBwdS4AMDIWADAyFgAwMhYAMDIWADAyFgDIsRcAAAAAAEA6IQDA3QwAwN0MAPCuHwCw5h0AQHg4AFAoNwDIpw0AGA84AIgPIgAAFiYA

atoms_occupancy:
AP4pAGCWDgCgjAAAoA8AACApGwBAnAAA4KsAAIB4IAAACT0AAAk9AAAJPQDg1A4AQH4FAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
wNoAAMDaAADA2gAA4KsAAOCrAADgqwAA4KsAAOCrAADQYQAAgFIAANBrAAAgywAAIMsAAMCPAABwrQAAsIEAANCEAAAwdQAAaGAAAKBzAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCJBgFQgAkIiQECkNCIwUhS0wGDC4oGJDPHxTgwwpYk8hprCh3GsMbsASWIbx6mUVil8DUIgTqyVTGiYLiUVUQbeNOgwmk8wFyGFwKvEzRLESaJFCSQJJoEC==


formula: Ca.682 Na.248 Pb.009 Ti.003 Al7.296 Fe.045 Mn.027 Li1.626 Si6 B3 F.669 O30.331 H3.331
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8343
b: 15.8343
c: 7.1012
alpha: 90
beta: 90
gamma: 120
cell_volume: 1541.914
crystal_density: 3.068
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L19, ordered model

atoms_x:
AAAAAAAAAAAAAAAAkMYDAJDGAwCQxgMAkMYDAJDGAwDw1w8AuJsLANBiNgAAAAAAAAAAABBhOQBYNggAaGo3AJieBQB4WQsA4GgRAJh6EABACAgA

atoms_y:
AAAAAAAAAAAAAAAAcEI5AHBCOQBwQjkAcEI5AHBCOQBAHBIAkLkLADCmBgAAAAAAAAAAAPCnAwCo0jQAmJ4FAGhqNwBQ7wsACHMRAKDLDADAADUA

atoms_z:
MHkuADB5LgAweS4A4DYWAOA2FgDgNhYA4DYWAOA2FgB4sRcAAAAAAPA+IQCw6AwAsOgMAGCtHwCw5h0AAHI4AAAtNwBIpQ0AIAw4AGgRIgBgBiYA

atoms_occupancy:
QKApAAAjDwCgjAAAoA8AAABeGgBg6gAAoIwAAMAUIQAACT0AAAk9AAAJPQAg1SgA4DMUAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
UNwAAFDcAABQ3AAA4KsAAOCrAADgqwAA4KsAAOCrAAAoXwAAiE8AANBrAABgKQMAYCkDACD9AAAQpAAAkH4AALCBAABgbQAAkGAAAIBwAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgFRAAkIiQECkNCQwVDS0wGDC4oGJHPHjThhwqYk9h5tCj9GsMb8AiWIbxymY1il8DUIgT6y9THioNi4V4QbuPKgxHk8wF0KGgKtEzRLEWaJFCSQRKoEE==


formula: Ca.682 Na.248 Pb.009 Ti.003 Al7.296 Fe.045 Mn.027 Li1.626 Si6 B3 F.669 O30.33 H3.33
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8343
b: 15.8343
c: 7.1012
alpha: 90
beta: 90
gamma: 120
cell_volume: 1541.914
crystal_density: 3.068
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L19, disordered model

atoms_x:
AAAAAAAAAAAAAAAAkMYDAJDGAwCQxgMAkMYDAJDGAwDw1w8AuJsLANBiNgBAqwAAQKsAAHDUOABYNggAaGo3AJieBQB4WQsA4GgRAJh6EABACAgA

atoms_y:
AAAAAAAAAAAAAAAAcEI5AHBCOQBwQjkAcEI5AHBCOQBAHBIAkLkLADCmBgAwVgEAMFYBAOAcAwCo0jQAmJ4FAGhqNwBQ7wsACHMRAKDLDADAADUA

atoms_z:
MHkuADB5LgAweS4A4DYWAOA2FgDgNhYA4DYWAOA2FgB4sRcAAAAAAPA+IQAg5wwAIOcMAGCtHwCw5h0AAHI4AAAtNwBIpQ0AIAw4AGgRIgBgBiYA

atoms_occupancy:
QKApAAAjDwCgjAAAoA8AAABeGgBg6gAAoIwAAMAUIQAACT0AAAk9AAAJPQBgnA0AwLYGAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
UNwAAFDcAABQ3AAA4KsAAOCrAADgqwAA4KsAAOCrAAAoXwAAiE8AANBrAADA2gAAwNoAABCLAAAQpAAAkH4AALCBAABgbQAAkGAAAIBwAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgFRAAkIiQECkNCQwVDS0wGDC4oGJHPHjThhwqYk9h5tCj9GsMb8AiWIbxymY1il8DUIgT6y9THioNi4V4QbuPKgxHk8wF0KGgKtEzRLEWaJFCSQRKoEE==


formula: Ca.691 Na.234 Pb.006 Ti.003 Al7.308 Fe.054 Mg.003 Mn.024 Li1.611 Si6 B3 F.679 O30.321 H3.321
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8303
b: 15.8303
c: 7.1017
alpha: 90
beta: 90
gamma: 120
cell_volume: 1541.243
crystal_density: 3.069
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L20, ordered model

atoms_x:
AAAAAAAAAAAAAAAA2MQDANjEAwDYxAMA2MQDANjEAwDYxAMAGNgPAGibCwBYZzYAAAAAAAAAAABoYzkAsDgIAEBqNwCQnAUA6FcLAChsEQDIdxAAUOQHAA==

atoms_y:
AAAAAAAAAAAAAAAAKEQ5AChEOQAoRDkAKEQ5AChEOQAoRDkAoBsSABi5CwCooQYAAAAAAAAAAACYpQMAUNA0AMCeBQBwbDcACPELAOh0EQCAyAwAQCY1AA==

atoms_z:
KHwuACh8LgAofC4AkDYWAJA2FgCQNhYAkDYWAJA2FgCQNhYAuLIXAAAAAACAQCEA0OsMANDrDAAQsh8AYOsdAEB4OABQKDcAWKQNAEAPOACwDyIAABYmAA==

atoms_occupancy:
4CwqAEBIDgDAXQAAoA8AAICcGgBAGQEAoA8AAAB9AACgxiAAAAk9AAAJPQAACT0AYHEpAKCXEwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
gNQAAIDUAACA1AAA8KAAAPCgAADwoAAA8KAAAPCgAADwoAAAMFwAAJhJAABgbQAAMP8CADD/AgBQ9QAAgKIAAFB4AADgeQAAQGoAADBcAADQawAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCRBgFQgAkIiQECkNCQwUjS0wGDC4oGJHPHxTggwpYk9hprCh9GsMb8ASWIbxymUVil8DUIgT6y1THioLi4VUQbuPKgxGk8wF0KGwKtEzRLEWaJFCSQRKoEE==


formula: Ca.691 Na.234 Pb.006 Ti.003 Al7.308 Fe.054 Mg.003 Mn.024 Li1.611 Si6 B3 F.678 O30.321 H3.321
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8303
b: 15.8303
c: 7.1017
alpha: 90
beta: 90
gamma: 120
cell_volume: 1541.243
crystal_density: 3.069
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L20, disordered model

atoms_x:
AAAAAAAAAAAAAAAA2MQDANjEAwDYxAMA2MQDANjEAwDYxAMAGNgPAGibCwBYZzYAcKgAAHCoAAAg2TgAsDgIAEBqNwCQnAUA6FcLAChsEQDIdxAAUOQHAA==

atoms_y:
AAAAAAAAAAAAAAAAKEQ5AChEOQAoRDkAKEQ5AChEOQAoRDkAoBsSABi5CwCooQYAgFEBAIBRAQDgHAMAUNA0AMCeBQBwbDcACPELAOh0EQCAyAwAQCY1AA==

atoms_z:
KHwuACh8LgAofC4AkDYWAJA2FgCQNhYAkDYWAJA2FgCQNhYAuLIXAAAAAACAQCEAIOcMACDnDADwrh8AYOsdAEB4OABQKDcAWKQNAEAPOACwDyIAABYmAA==

atoms_occupancy:
4CwqAEBIDgDAXQAAoA8AAICcGgBAGQEAoA8AAAB9AACgxiAAAAk9AAAJPQAACT0AQMsNAOCHBgCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
gNQAAIDUAACA1AAA8KAAAPCgAADwoAAA8KAAAPCgAADwoAAAMFwAAJhJAABgbQAAoNcAAKDXAABghgAAgKIAAFB4AADgeQAAQGoAADBcAADQawAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCRBgFQgAkIiQECkNCQwUjS0wGDC4oGJHPHxTggwpYk9hprCh9GsMb8ASWIbxymUVil8DUIgT6y1THioLi4VUQbuPKgxGk8wF0KGwKtEzRLEWaJFCSQRKoEE==


formula: Ca.638 Na.284 Pb.006 Ti.006 Al7.251 Fe.132 Mg.015 Mn.03 Li1.566 Si6 B3 F.668 O30.332 H3.332
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8399
b: 15.8399
c: 7.1030
alpha: 90
beta: 90
gamma: 120
cell_volume: 1543.396
crystal_density: 3.072
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L21, ordered model

atoms_x:
AAAAAAAAAAAAAAAAGMYDABjGAwAYxgMAGMYDABjGAwAYxgMAqNkPAOCbCwBIYzYAAAAAAAAAAADAYDkAMDYIALBoNwAgngUA6FwLAFhpEQCwexAAYD0IAA==

atoms_y:
AAAAAAAAAAAAAAAA6EI5AOhCOQDoQjkA6EI5AOhCOQDoQjkAIB4SAOC5CwC4pQYAAAAAAAAAAABAqAMA0NI0AFCgBQDgajcAOPMLACB0EQBozAwAoMs0AA==

atoms_z:
WIMuAFiDLgBYgy4AiEMWAIhDFgCIQxYAiEMWAIhDFgCIQxYACLMXAAAAAAAQQiEAMPUMADD1DAAwtR8AQOgdABCAOACQLjcA4KgNAJgROACYEyIAQDUmAA==

atoms_occupancy:
wPAmAIBVEQDAXQAAQB8AAKBzGQCArwIAIE4AAECcAABA3B8AAAk9AAAJPQAACT0AgMUoAIBDFAAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
sOUAALDlAACw5QAAEKQAABCkAAAQpAAAEKQAABCkAAAQpAAAgFwAADBNAABAagAA8EMDAPBDAwCABgEAYJ8AAAB9AABghgAA8G4AAFBfAACgcwAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMFkNCQgdDSkwEDC4oGKHNLjXhhxqYk9h5tCj+GsMb8AimI7xzGY5Cl4DUYgV+y5lHioNi414gTuPKgxHFcwJ0KHgTdE2SLIUSRGGyQSSoEE==


formula: Ca.638 Na.284 Pb.006 Ti.006 Al7.251 Fe.132 Mg.015 Mn.03 Li1.566 Si6 B3 F.666 O30.333 H3.333
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8399
b: 15.8399
c: 7.1030
alpha: 90
beta: 90
gamma: 120
cell_volume: 1543.396
crystal_density: 3.072
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L21, disordered model

atoms_x:
AAAAAAAAAAAAAAAAGMYDABjGAwAYxgMAGMYDABjGAwAYxgMAqNkPAOCbCwBIYzYACKwAAAisAAAwzjgAMDYIALBoNwAgngUA6FwLAFhpEQCwexAAYD0IAA==

atoms_y:
AAAAAAAAAAAAAAAA6EI5AOhCOQDoQjkA6EI5AOhCOQDoQjkAIB4SAOC5CwC4pQYAwFcBAMBXAQBQGwMA0NI0AFCgBQDgajcAOPMLACB0EQBozAwAoMs0AA==

atoms_z:
WIMuAFiDLgBYgy4AiEMWAIhDFgCIQxYAiEMWAIhDFgCIQxYACLMXAAAAAAAQQiEA8O4MAPDuDABgrR8AQOgdABCAOACQLjcA4KgNAJgROACYEyIAQDUmAA==

atoms_occupancy:
wPAmAIBVEQDAXQAAQB8AAKBzGQCArwIAIE4AAECcAABA3B8AAAk9AAAJPQAACT0AwIwNAGDGBgCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
sOUAALDlAACw5QAAEKQAABCkAAAQpAAAEKQAABCkAAAQpAAAgFwAADBNAABAagAAgO0AAIDtAAAQiwAAYJ8AAAB9AABghgAA8G4AAFBfAACgcwAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMFkNCQgdDSkwEDC4oGKHNLjXhhxqYk9h5tCj+GsMb8AimI7xzGY5Cl4DUYgV+y5lHioNi414gTuPKgxHFcwJ0KHgTdE2SLIUSRGGyQSSoEE==


formula: Ca.683 Na.247 Pb.006 Ti.003 Al7.239 Fe.063 Mg.027 Mn.036 Li1.632 Si6 B3 F.638 O30.362 H3.362
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8306
b: 15.8306
c: 7.0999
alpha: 90
beta: 90
gamma: 120
cell_volume: 1540.911
crystal_density: 3.070
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L22, ordered model

atoms_x:
AAAAAAAAAAAAAAAAoMUDAKDFAwCgxQMAoMUDAKDFAwCgxQMAuNgPAKicCwBAZjYAAAAAAAAAAAAAYjkA8DQIAMhpNwConQUAwFcLAJhqEQCAeRAAMPoHAA==

atoms_y:
AAAAAAAAAAAAAAAAYEM5AGBDOQBgQzkAYEM5AGBDOQBgQzkAaBwSAOC5CwDAogYAAAAAAAAAAAAApwMAENQ0ADifBQBYazcAGPALAFB2EQDQyAwA0A41AA==

atoms_z:
UHcuAFB3LgBQdy4AwD0WAMA9FgDAPRYAwD0WAMA9FgDAPRYAOLAXAAAAAACQTiEAEPIMABDyDADguR8AkOMdALB2OABQKDcA4KgNAHAMOADgESIAoCUmAA==

atoms_occupancy:
4K8pAGATDwDAXQAAoA8AACA1GQAgSAEAoIwAAIC7AAAANCEAAAk9AAAJPQAACT0AwPAmAEAYFgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
8NIAAPDSAADw0gAAUJEAAFCRAABQkQAAUJEAAFCRAABQkQAAEFkAAPBGAAAgZwAA4AMDAOADAwDwBAEAQJwAADB1AABAgwAAIGcAAFBfAACAcAAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCRBgFQgAkIiQECkNCQwUhS0oGDC4oGJHPHxTgwwpYk8hptCh9GsMbsASWIbx6mUVil8DUIgTqyVTGikLiUVUQbmNOQwmk2wEyJFwKvEzRKkSaJFCSQJJoEC==


formula: Ca.683 Na.247 Pb.006 Ti.003 Al7.239 Fe.063 Mg.027 Mn.036 Li1.632 Si6 B3 F.639 O30.36 H3.36
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8306
b: 15.8306
c: 7.0999
alpha: 90
beta: 90
gamma: 120
cell_volume: 1540.911
crystal_density: 3.069
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L22, disordered model

atoms_x:
AAAAAAAAAAAAAAAAoMUDAKDFAwCgxQMAoMUDAKDFAwCgxQMAuNgPAKicCwBAZjYAUKoAAFCqAADQ3TgA8DQIAMhpNwConQUAwFcLAJhqEQCAeRAAMPoHAA==

atoms_y:
AAAAAAAAAAAAAAAAYEM5AGBDOQBgQzkAYEM5AGBDOQBgQzkAaBwSAOC5CwDAogYAEFMBABBTAQCwJAMAENQ0ADifBQBYazcAGPALAFB2EQDQyAwA0A41AA==

atoms_z:
UHcuAFB3LgBQdy4AwD0WAMA9FgDAPRYAwD0WAMA9FgDAPRYAOLAXAAAAAACQTiEA8O4MAPDuDADAth8AkOMdALB2OABQKDcA4KgNAHAMOADgESIAoCUmAA==

atoms_occupancy:
4K8pAGATDwDAXQAAoA8AACA1GQAgSAEAoIwAAIC7AAAANCEAAAk9AAAJPQAACT0AIAANAABTBwCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
8NIAAPDSAADw0gAAUJEAAFCRAABQkQAAUJEAAFCRAABQkQAAEFkAAPBGAAAgZwAAkMkAAJDJAADwoAAAQJwAADB1AABAgwAAIGcAAFBfAACAcAAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCRBgFQgAkIiQECkNCQwUhS0oGDC4oGJHPHxTgwwpYk8hptCh9GsMbsASGIbx6mUVil8DUIgTqyVTGikLiUVUQbmNOQwmk2wEyJFwKvEzRKkSaJFCSQJJoEC==


formula: Ca.695 Na.24 Pb.007 Ti.003 Al7.317 Fe.057 Mg.021 Mn.033 Li1.569 Si6 B3 F.678 O30.322 H3.322
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8299
b: 15.8299
c: 7.1009
alpha: 90
beta: 90
gamma: 120
cell_volume: 1540.992
crystal_density: 3.075
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L23, ordered model

atoms_x:
AAAAAAAAAAAAAAAA+McDAPjHAwD4xwMA+McDAPjHAwD4xwMA8NcPALibCwCIZDYAAAAAAAAAAACgYjkASDcIABBoNwAInQUA8FkLAEhqEQD4eRAAwPsHAA==

atoms_y:
AAAAAAAAAAAAAAAACEE5AAhBOQAIQTkACEE5AAhBOQAIQTkA8BsSAOC5CwB4pAYAAAAAAAAAAABgpgMAuNE0APCgBQD4azcACPELAEh0EQCIygwAQA01AA==

atoms_z:
WHkuAFh5LgBYeS4AED4WABA+FgAQPhYAED4WABA+FgAQPhYAeLEXAAAAAADwPiEAQOoMAEDqDABQuB8AIOUdALB2OAC4JDcAOKYNAGANOAAwDSIAwPYlAA==

atoms_occupancy:
YGsqAACmDgBgbQAAoA8AAGDLGgDgKAEAYG0AAOCrAADg6x8AAAk9AAAJPQAACT0AwGEpAECnEwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
UNwAAFDcAABQ3AAAgKIAAICiAACAogAAgKIAAICiAACAogAAEF4AAJhOAABAagAAQA0DAEANAwAg/QAAgKIAACCAAACwgQAAIGwAANheAAAAcwAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCRBgFQgAkIiQECkNCQwUjS0wGDC4oGJHPHxTgwwpYk9hprCh9GsMbsASWIbx6mUVil8DUIgT6yVTHioLi0VUQbePKgwmk8wFyKFwKvEzRLEWaJFCSQJKoEE==


formula: Ca.695 Na.24 Pb.007 Ti.003 Al7.317 Fe.057 Mg.021 Mn.033 Li1.569 Si6 B3 F.678 O30.51 H3.51
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8299
b: 15.8299
c: 7.1009
alpha: 90
beta: 90
gamma: 120
cell_volume: 1540.992
crystal_density: 3.085
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L23, disordered model

atoms_x:
AAAAAAAAAAAAAAAA+McDAPjHAwD4xwMA+McDAPjHAwD4xwMA8NcPALibCwCIZDYAOKkAADipAACI1TgASDcIABBoNwAInQUA8FkLAEhqEQD4eRAAwPsHAA==

atoms_y:
AAAAAAAAAAAAAAAACEE5AAhBOQAIQTkACEE5AAhBOQAIQTkA8BsSAOC5CwB4pAYAEFMBABBTAQDYGgMAuNE0APCgBQD4azcACPELAEh0EQCIygwAQA01AA==

atoms_z:
WHkuAFh5LgBYeS4AED4WABA+FgAQPhYAED4WABA+FgAQPhYAeLEXAAAAAADwPiEAIOcMACDnDAAwtR8AIOUdALB2OAC4JDcAOKYNAGANOAAwDSIAwPYlAA==

atoms_occupancy:
YGsqAACmDgBgbQAAoA8AAGDLGgDgKAEAYG0AAOCrAADg6x8AAAk9AAAJPQAACT0AQMsNAEBgCgCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
UNwAAFDcAABQ3AAAgKIAAICiAACAogAAgKIAAICiAACAogAAEF4AAJhOAABAagAAwNoAAMDaAACAiQAAgKIAACCAAACwgQAAIGwAANheAAAAcwAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCRBgFQgAkIiQECkNCQwUjS0wGDC4oGJHPHxTgwwpYk9hprCh9GsMbsASWIbx6mUVil8DUIgT6yVTHioLi0VUQbePKgwmk8wFyKFwKvEzRLEWaJFCSQJKoEE==


formula: Ca.684 Na.238 Pb.013 Al7.293 Fe.039 Mn.048 Li1.62 Si6 B3 F.712 O30.288 H3.288
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8286
b: 15.8286
c: 7.1012
alpha: 90
beta: 90
gamma: 120
cell_volume: 1540.804
crystal_density: 3.074
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L24, ordered model

atoms_x:
AAAAAAAAAAAAAAAAuMYDALjGAwC4xgMAuMYDAJDYDwC4mwsA2GQ2AAAAAAAAAAAAwGA5AOg3CABQaTcAGJwFAGhaCwCIaxEA0HkQAAAbCAA=

atoms_y:
AAAAAAAAAAAAAAAASEI5AEhCOQBIQjkASEI5AGgcEgBouQsAKKQGAAAAAAAAAAAAQKgDABjRNACwnwUA6Gw3ANDxCwD4cxEA+MgMAADuNAA=

atoms_z:
mHAuAJhwLgCYcC4AWDwWAFg8FgBYPBYAWDwWABiyFwAAAAAAUEghAGDtDABg7QwAMLUfAEDoHQBAeDgAwCY3AKipDQCIDTgA+A0iAGAGJgA=

atoms_occupancy:
gL8pAMCGDgAgywAAYE4aACDLAAAA+gAAgPUgAAAJPQAACT0AAAk9AAB1KwAAlBEAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
ENYAABDWAAAQ1gAA4KsAAOCrAADgqwAA4KsAAFBfAABITgAAIGcAACAKAwAgCgMAAPoAAPCgAACQfgAAQIMAAKBzAADgYAAAoHMAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCRBgFQgAkIiQECkNCIwUjS0wGDC4oGJDPHxTgwwpYk8hprCh1GsMbsASWIbx6mUVil8DUIgT6yVTHiYLi0VUQbePKgwmk8wFyKFwKvEzRLEWaJFCSQJJoEE==


formula: Ca.684 Na.238 Pb.013 Al7.293 Fe.039 Mn.048 Li1.62 Si6 B3 F.711 O30.288 H3.288
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8286
b: 15.8286
c: 7.1012
alpha: 90
beta: 90
gamma: 120
cell_volume: 1540.804
crystal_density: 3.074
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L24, disordered model

atoms_x:
AAAAAAAAAAAAAAAAuMYDALjGAwC4xgMAuMYDAJDYDwC4mwsA2GQ2ANipAADYqQAA4NI4AOg3CABQaTcAGJwFAGhaCwCIaxEA0HkQAAAbCAA=

atoms_y:
AAAAAAAAAAAAAAAASEI5AEhCOQBIQjkASEI5AGgcEgBouQsAKKQGABBTAQAQUwEA4BwDABjRNACwnwUA6Gw3ANDxCwD4cxEA+MgMAADuNAA=

atoms_z:
mHAuAJhwLgCYcC4AWDwWAFg8FgBYPBYAWDwWABiyFwAAAAAAUEghAEDqDABA6gwAgLAfAEDoHQBAeDgAwCY3AKipDQCIDTgA+A0iAGAGJgA=

atoms_occupancy:
gL8pAMCGDgAgywAAYE4aACDLAAAA+gAAgPUgAAAJPQAACT0AAAk9ACB3DgAA3AUAgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
ENYAABDWAAAQ1gAA4KsAAOCrAADgqwAA4KsAAFBfAABITgAAIGcAAIDUAACA1AAAAIcAAPCgAACQfgAAQIMAAKBzAADgYAAAoHMAAGDqAAA=

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiEAACIgEgUhQCRBgFQgAkIiQECkNCIwUjS0wGDC4oGJDPHxTgwwpYk8hprCh1GsMbsASWIbx6mUVil8DUIgT6yVTHiYLi0VUQbePKgwmk8wFyKFwKvEzRLEWaJFCSQJJoEE==


formula: Ca.61 Na.322 Pb.007 Ti.006 Al7.14 Fe.12 Mg.057 Mn.06 Li1.614 Si6 B3 F.633 O30.337 H3.337
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8438
b: 15.8438
c: 7.1043
alpha: 90
beta: 90
gamma: 120
cell_volume: 1544.438
crystal_density: 3.066
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L25, ordered model

atoms_x:
AAAAAAAAAAAAAAAAIMgDACDIAwAgyAMAIMgDACDIAwAgyAMASNoPAJCbCwBYYjYAAAAAAAAAAAD4XzkAeDkIAChpNwDQnQUAeF4LAEhqEQAAfBAAQAgIAA==

atoms_y:
AAAAAAAAAAAAAAAA4EA5AOBAOQDgQDkA4EA5AOBAOQDgQDkAIB4SALi5CwCopgYAAAAAAAAAAAAIqQMAiM80ANifBQAwazcAaPULADBzEQDwywwAwAA1AA==

atoms_z:
iHsuAIh7LgCIey4AGE8WABhPFgAYTxYAGE8WABhPFgAYTxYAcK8XAAAAAADwPiEAEPIMABDyDADAth8AQOgdAPB8OAAALTcAEKYNADgNOABYDSIAYAYmAA==

atoms_occupancy:
QDslAECnEwBgbQAAQB8AAIAxFwAAcQIA4CgBAIA4AQBA1iAAAAk9AAAJPQAACT0AoKImAKCRFAAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
AOEAAADhAAAA4QAAIJkAACCZAAAgmQAAIJkAACCZAAAgmQAA6F0AAABLAACQZQAA4DUDAOA1AwBQ9QAAIJkAAAB9AABwewAAQGoAAOBgAAAwdQAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQARAiIAACIgEgUhQCSBgGRAAkIigMFoNCQgtDSowEDC4oGKHNLjXhhxqRIth5tCj+GoMb8AkkI+x3MYpCl4DkYgV+y5lFioNi414gTuLKhRNFcwJ0KLgTdI2STIUyRKG0QSTIEE==


formula: Ca.61 Na.322 Pb.007 Ti.006 Al7.14 Fe.12 Mg.057 Mn.06 Li1.614 Si6 B3 F.633 O30.336 H3.336
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8438
b: 15.8438
c: 7.1043
alpha: 90
beta: 90
gamma: 120
cell_volume: 1544.438
crystal_density: 3.066
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L25, disordered model

atoms_x:
AAAAAAAAAAAAAAAAIMgDACDIAwAgyAMAIMgDACDIAwAgyAMASNoPAJCbCwBYYjYAQLAAAECwAADAzzgAeDkIAChpNwDQnQUAeF4LAEhqEQAAfBAAQAgIAA==

atoms_y:
AAAAAAAAAAAAAAAA4EA5AOBAOQDgQDkA4EA5AOBAOQDgQDkAIB4SALi5CwCopgYAIGEBACBhAQBQGwMAiM80ANifBQAwazcAaPULADBzEQDwywwAwAA1AA==

atoms_z:
iHsuAIh7LgCIey4AGE8WABhPFgAYTxYAGE8WABhPFgAYTxYAcK8XAAAAAADwPiEA8O4MAPDuDACgsx8AQOgdAPB8OAAALTcAEKYNADgNOABYDSIAYAYmAA==

atoms_occupancy:
QDslAECnEwBgbQAAQB8AAIAxFwAAcQIA4CgBAIA4AQBA1iAAAAk9AAAJPQAACT0A4OAMAADWBgCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
AOEAAADhAAAA4QAAIJkAACCZAAAgmQAAIJkAACCZAAAgmQAA6F0AAABLAACQZQAAUMMAAFDDAABwewAAIJkAAAB9AABwewAAQGoAAOBgAAAwdQAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQARAiIAACIgEgUhQCSBgGRAAkIigMFoNCQgtDSowEDC4oGKHNLjXhhxqRIth5tCj+GoMb8AkkI+x3MYpCl4DkYgV+y5lFioNi414gTuLKhRNFcwJ0KLgTdI2STIUyRKG0QSTIEE==


formula: Ca.66 Na.272 Pb.005 Ti.009 Al7.194 Fe.093 Mn.051 Li1.647 Si6 B3 O30.566 F.434 H3.566
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8368
b: 15.8368
c: 7.1014
alpha: 90
beta: 90
gamma: 120
cell_volume: 1542.444
crystal_density: 3.067
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L26, ordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "O-H(1o)", "F(1o)", "O(2o)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAyMUDAMjFAwDIxQMAyMUDAMjFAwBI2g8A8JoLAGhmNgAAAAAAAAAAAPhfOQAoOQgAAGk3AFidBQDoXAsAKGwRAKh5EACAwwcA

atoms_y:
AAAAAAAAAAAAAAAAOEM5ADhDOQA4QzkAOEM5ADhDOQBwHhIAGLkLAJiiBgAAAAAAAAAAAAipAwDYzzQAAKAFAKhrNwDI9AsA6HQRACjLDACARTUA

atoms_z:
GH0uABh9LgAYfS4A6EIWAOhCFgDoQhYA6EIWAOhCFgCorhcAAAAAAEA6IQCA8AwAgPAMAHC7HwDw7B0AYHs4AAAtNwAYow0AiA04ABgMIgBAuCUA

atoms_occupancy:
gEgoAACaEAAgTgAA4C4AAMBKGABg5AEAoAkBACCCIQAACT0AAAk9AAAJPQDAiyIAQH0aAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
IOQAACDkAAAg5AAA0LYAANC2AADQtgAA0LYAANC2AACwXgAAkEwAAFBfAADQQAMA0EADAAD6AAAgmQAAkH4AANCEAADwbgAAUF8AABByAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMCkNCQwVDSkwGDC4oGKHPHjThhxqYk9h5tCj9GsMb8AimIbxzGY1Cl4DUYgT6y5zHioNi4V4QTuPKgxHFcwJ0KGgKtEzRLEWaJGCSQRKoEE==


formula: Ca.66 Na.272 Pb.005 Ti.009 Al7.194 Fe.093 Mn.051 Li1.647 Si6 B3 O30.567 F.432 H3.567
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8368
b: 15.8368
c: 7.1014
alpha: 90
beta: 90
gamma: 120
cell_volume: 1542.444
crystal_density: 3.067
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L26, disordered model

atoms_sites:
["CaX", "NaX", "PbX", "TiY", "AlY", "FeY", "MnY", "LiY", "AlZ", "SiT", "B", "O-H(1d)", "F(1d)", "O(2d)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "H(3)"]

atoms_x:
AAAAAAAAAAAAAAAAyMUDAMjFAwDIxQMAyMUDAMjFAwBI2g8A8JoLAGhmNgDQpwAA0KcAAADWOAAoOQgAAGk3AFidBQDoXAsAKGwRAKh5EACAwwcA

atoms_y:
AAAAAAAAAAAAAAAAOEM5ADhDOQA4QzkAOEM5ADhDOQBwHhIAGLkLAJiiBgDwTwEA8E8BAJAhAwDYzzQAAKAFAKhrNwDI9AsA6HQRACjLDACARTUA

atoms_z:
GH0uABh9LgAYfS4A6EIWAOhCFgDoQhYA6EIWAOhCFgCorhcAAAAAAEA6IQDQ6wwA0OsMAICwHwDw7B0AYHs4AAAtNwAYow0AiA04ABgMIgBAuCUA

atoms_occupancy:
gEgoAACaEAAgTgAA4C4AAMBKGABg5AEAoAkBACCCIQAACT0AAAk9AAAJPQAgiQsAAMoIAICEHgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
IOQAACDkAAAg5AAA0LYAANC2AADQtgAA0LYAANC2AACwXgAAkEwAAFBfAADQOQAA0DkAAMCPAAAgmQAAkH4AANCEAADwbgAAUF8AABByAABg6gAA

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMCkNCQwVDSkwGDC4oGKHPHjThhxqYk9h5tCj9GsMb8AimIbxzGY1Cl4DUYgT6y5zHioNi4V4QTuPKgxHFcwJ0KGgKtEzRLEWaJGCSQRKoEE==


formula: Ca.614 Na.311 Pb.006 Ti.018 Al7.272 Fe.156 Mg.018 Mn.057 Li1.482 Si6 B3 F.633 O30.367 H3.367
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8333
b: 15.8333
c: 7.1025
alpha: 90
beta: 90
gamma: 120
cell_volume: 1542.001
crystal_density: 3.085
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L27, ordered model

atoms_x:
AAAAAAAAAAAAAAAAGMYDABjGAwAYxgMAGMYDABjGAwAYxgMA4NgPADCcCwB4ZTYAAAAAAAAAAAD4XzkA4DoIAJBqNwCAnQUAqFsLAIBpEQCYehAAAAIIAA==

atoms_y:
AAAAAAAAAAAAAAAA6EI5AOhCOQDoQjkA6EI5AOhCOQDoQjkACB0SADC6CwCIowYAAAAAAAAAAAAIqQMAIM40AHCeBQCAazcAwPILADBzEQAAywwAAAc1AA==

atoms_z:
mHouAJh6LgCYei4A0EsWANBLFgDQSxYA0EsWANBLFgDQSxYAOLAXAAAAAACgQyEAYO0MAGDtDADguR8AsOYdAPB8OACQLjcAwKUNAKgLOABwDiIAwPYlAA==

atoms_occupancy:
wHklAGD7EgDAXQAAwF0AAADhGQCALAMAwF0AAOAoAQDAJh4AAAk9AAAJPQAACT0AoKImAGBmFgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
sOUAALDlAACw5QAAAK8AAACvAAAArwAAAK8AAACvAAAArwAAyF8AACBOAACwaAAA0A4DANAOAwBw+AAA8KAAALCBAADwhwAAQGoAAHBiAAAQcgAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgFRAAkIiQECkNCQgcjS0wGDC4oGJHPHjThhwqYk9h5tCj9GsMb8AimIbxymY1il8DUYgT6y9THioNi4V4QbuPKgxHlcwJ0KHgK9E1RLIUaRGCyQTKoEE==


formula: Ca.614 Na.311 Pb.006 Ti.018 Al7.272 Fe.156 Mg.018 Mn.057 Li1.482 Si6 B3 F.633 O30.366 H3.366
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8333
b: 15.8333
c: 7.1025
alpha: 90
beta: 90
gamma: 120
cell_volume: 1542.001
crystal_density: 3.085
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L27, disordered model

atoms_x:
AAAAAAAAAAAAAAAAGMYDABjGAwAYxgMAGMYDABjGAwAYxgMA4NgPADCcCwB4ZTYAuKsAALirAAAwzjgA4DoIAJBqNwCAnQUAqFsLAIBpEQCYehAAAAIIAA==

atoms_y:
AAAAAAAAAAAAAAAA6EI5AOhCOQDoQjkA6EI5AOhCOQDoQjkACB0SADC6CwCIowYAwFcBAMBXAQAwGAMAIM40AHCeBQCAazcAwPILADBzEQAAywwAAAc1AA==

atoms_z:
mHouAJh6LgCYei4A0EsWANBLFgDQSxYA0EsWANBLFgDQSxYAOLAXAAAAAACgQyEA8O4MAPDuDADguR8AsOYdAPB8OACQLjcAwKUNAKgLOABwDiIAwPYlAA==

atoms_occupancy:
wHklAGD7EgDAXQAAwF0AAADhGQCALAMAwF0AAOAoAQDAJh4AAAk9AAAJPQAACT0A4OAMAEByBwCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
sOUAALDlAACw5QAAAK8AAACvAAAArwAAAK8AAACvAAAArwAAyF8AACBOAACwaAAAsMwAALDMAAAAfQAA8KAAALCBAADwhwAAQGoAAHBiAAAQcgAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgFRAAkIiQECkNCQgcjS0wGDC4oGJHPHjThhwqYk9h5tCj9GsMb8AimIbxymY1il8DUYgT6y9THioNi4V4QbuPKgxHlcwJ0KHgK9E1RLIUaRGCyQTKoEE==


formula: Ca.63 Na.338 Pb.007 Ti.012 Al7.203 Fe.123 Mg.069 Mn.069 Li1.524 Si6 B3 F.691 O30.309 H3.309
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8404
b: 15.8404
c: 7.1039
alpha: 90
beta: 90
gamma: 120
cell_volume: 1543.689
crystal_density: 3.081
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L28, ordered model

atoms_x:
AAAAAAAAAAAAAAAAUMoDAFDKAwBQygMAUMoDAFDKAwBQygMAmNoPALibCwAIYjYAAAAAAAAAAACAXzkAKDkIAKBpNwBwngUAaF8LALBrEQDQeRAAMCwIAA==

atoms_y:
AAAAAAAAAAAAAAAAsD45ALA+OQCwPjkAsD45ALA+OQCwPjkAOB8SAOC5CwD4pgYAAAAAAAAAAACAqQMA2M80AGCfBQCQajcAGPULALhyEQCIygwA0Nw0AA==

atoms_z:
yHcuAMh3LgDIdy4AmGAWAJhgFgCYYBYAmGAWAJhgFgCYYBYAWK4XAAAAAACAQCEAoPMMAKDzDABwux8AkOMdABCAOABAMzcAYKYNACgOOADwCyIAoCUmAA==

atoms_occupancy:
wHMmAEChFABgbQAAgD4AAKB5GACggAIAYGcBAGBnAQCAAR8AAAk9AAAJPQAACT0A4CwqACDcEgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
EO8AABDvAAAQ7wAAgKIAAICiAACAogAAgKIAAICiAACAogAAuGAAAMBOAACwaAAAYEIDAGBCAwAA+gAAYJ8AAECDAAAggAAA8G4AAABfAADAdgAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMFkNCQgdDSowEDC4oGKHNLjXhhxqYk9h5tCj+GsMb8AikI7xTMY5Cl4DUYgV+y5lHioNi414gTuPKgxNFcwJ0KLgTdI2STIUSRKG0QSTIEE==


formula: Ca.63 Na.338 Pb.007 Ti.012 Al7.203 Fe.123 Mg.069 Mn.069 Li1.524 Si6 B3 F.69 O30.309 H3.309
compound: Anjanabonoina, central Madagascar
formula_title: <missing>
a: 15.8404
b: 15.8404
c: 7.1039
alpha: 90
beta: 90
gamma: 120
cell_volume: 1543.689
crystal_density: 3.081
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:
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L28, disordered model

atoms_x:
AAAAAAAAAAAAAAAAUMoDAFDKAwBQygMAUMoDAFDKAwBQygMAmNoPALibCwAIYjYAeK8AAHivAABQ0TgAKDkIAKBpNwBwngUAaF8LALBrEQDQeRAAMCwIAA==

atoms_y:
AAAAAAAAAAAAAAAAsD45ALA+OQCwPjkAsD45ALA+OQCwPjkAOB8SAOC5CwD4pgYAkF8BAJBfAQDgHAMA2M80AGCfBQCQajcAGPULALhyEQCIygwA0Nw0AA==

atoms_z:
yHcuAMh3LgDIdy4AmGAWAJhgFgCYYBYAmGAWAJhgFgCYYBYAWK4XAAAAAACAQCEAgPAMAIDwDADguR8AkOMdABCAOABAMzcAYKYNACgOOADwCyIAoCUmAA==

atoms_occupancy:
wHMmAEChFABgbQAAgD4AAKB5GACggAIAYGcBAGBnAQCAAR8AAAk9AAAJPQAACT0AwAkOAGBJBgCAhB4AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
EO8AABDvAAAQ7wAAgKIAAICiAACAogAAgKIAAICiAACAogAAuGAAAMBOAACwaAAAAOEAAADhAABghgAAYJ8AAECDAAAggAAA8G4AAABfAADAdgAAYOoAAA==

qdat:
AAAAAAAAAAAAAQAACAAAAQBAAgEAAAEQAQgiIAACIgEgUhQCSBgGRAAkIiQMFkNCQgdDSowEDC4oGKHNLjXhhxqYk9h5tCj+GsMb8AikI7xTMY5Cl4DUYgV+y5lHioNi414gTuPKgxNFcwJ0KLgTdI2STIUSRKG0QSTIEE==


formula: Al3 P2 O16 H13
compound: Fumade, Tarn, France
formula_title: <missing>
a: 7.386
b: 7.716
c: 11.345
alpha: 99.773
beta: 91.141
gamma: 115.58
cell_volume: 571.551
crystal_density: 2.394
atoms_occupancy: 0
pub_title:
 Afmite, Al3(OH)4(H2O)3(PO4)(PO3OH)*H2O,a new mineral from Fumade, Tarn, France:
 description and crystal structure
 T = 298 K

atoms_sites:
["Al1", "Al2", "Al3", "P1", "P2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O-H8", "O-H9", "O-H10", "O-H11", "O-H12", "Wat13", "Wat14", "Wat15", "Wat16"]

atoms_x:
gGALAGAGDQAgkRIAIAgUABDdAwAgVwsAgMYTAEA6IQDQVhAAsDMNAJBaBgDQfjMA0HkGAABbDgCAsDgA4CoJAOA1HACgHR8AYG42AFDNDwCgKR0A

atoms_y:
kLAyAAC8GwBwVjQAYKEIALAyCQBgUDsAIOUEAMAoDQCA/hIA8OMSACBjOwBwwQUAYEsOAHBAJwAgkRIA8J0mAIAbPACA3SQA0EMoAABnJQAQ1S4A

atoms_z:
YH4rAHD8KQDAIxIAADQhANBGNACwcSQAMPgYAPCpJACACCIAUOgwANAzMwAQ3DEAoM08ALC8JADwGicA4E0xALBhLwCwbS0AMNAnAPDICgCQjTwA

atoms_u_iso:
QJYBAAB3AQBAGQEAQBkBAOClAQAAdwEAwNQBAGDkAQDAVwEAgDgBAAB3AQAA+gAAIEgBAOClAQDgpQEAwFcBAEATAgDgpQEAQJYBACDFAQCALAMA

atoms_aniso_label:
["Al1", "Al2", "Al3", "P1", "P2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O-H8", "O-H9", "O-H10", "O-H11", "O-H12", "Wat13", "Wat14", "Wat15", "Wat16"]

atoms_aniso_u11:
YOQBAOAoAQCAuwAAoAkBAMBXAQDA2gAAQJwAAADuAgDAVwEAIMUBAMDUAQBAnAAAgDgBAMBRAgAgSAEAYOoAACDLAADAVwEAQBkBAGDkAQDgnwIA

atoms_aniso_u22:
AH0AAGDkAQCgCQEAwNoAAOClAQDgHAMAAHECAKAJAQAA9AEAAAAAAECWAQCgCQEAYOoAAAD0AQCghgEAIMsAAMDUAQDgIgIAIE4AAECWAQAA7gIA

atoms_aniso_u33:
4CICAMBXAQDAVwEAwFcBACDFAQBAGQEAYOQBAEATAgAgSAEAYOQBAAD0AQAA9AEAQJYBAGDkAQDgpQEA4CICACBCAgCAOAEAwFECAEANAwDgnwIA

atoms_aniso_u12:
gD4AAOCrAADgLgAAYG0AAAB9AACAOAEAQB8AAOAoAQDgKAEAIE4AAAB3AQCgjAAAIE4AAAD0AQBAHwAAYPD//0Ci//+AuwAAIFT//+ClAQCgDwAA

atoms_aniso_u13:
gD4AAKAPAACAPgAAoA8AAMBdAABAnAAA4KsAAMDg//8gVP//IE4AAOCrAAAA+gAAYPD//8DaAABAnAAAQB8AAMDaAAAg0f//AH0AAEAZAQAgTgAA

atoms_aniso_u23:
4KsAAGBtAAAgTgAAoA8AACBOAAAgSAEAoIwAAOAuAAAgywAAgD4AAGDqAACAOAEAIE4AAMBdAAAAfQAAYOoAACDR//+gDwAAgD4AAMBXAQAgTgAA

qdat:
AAAAAAAAAIAAAAAJAABUAAAAABEAICCCABiQACEgJAooECgWBKASJUBIkGiaYcAUpg8nCtULsQCJxE07cE3W3yXNrwOu6Wfz7beWrd8NavdHrfWv+O5r5+3+v1517jnfX/s4O/z/T/Tm9rP3fl/N937/2f2m7H/97n/cvb==


formula: Ca2.907 V1.934 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 12.0790
b: 12.0790
c: 12.0790
alpha: 90
beta: 90
gamma: 90
cell_volume: 1762.353
crystal_density: 3.703
atoms_sites: ["Ca", "V", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAEGYCAA==
atoms_y: AAAAAAAAAAAAAAAAkO8CAA==
atoms_z: QEIPAAAAAABAQg8A8PsnAA==
atoms_occupancy: oCQ7AGAFOwAACT0AAAk9AA==
atoms_u_iso: oHMAANBSAABAUQAAwI8AAA==
atoms_aniso_label: ["Ca", "V", "Si", "O"]
atoms_aniso_u11: UF8AANBSAABQRgAAMI4AAA==
atoms_aniso_u22: AH0AANBSAADwVQAAgIkAAA==
atoms_aniso_u33: AH0AANBSAADwVQAAkJcAAA==
atoms_aniso_u12: AAAAACADAAAAAAAAQAYAAA==
atoms_aniso_u13: AAAAACADAAAAAAAA4LH//w==
atoms_aniso_u23: 4BUAACADAAAAAAAA4Pz//w==
pub_title:
 The effect of fO2 on the partitioning and valence of V and Cr in garnet/melt
 pairs and the relation to terrestrial mantle V and Cr content
 Note: R090043

qdat:
AAAAAAAAAAAAAAAAAAAAAQAAEAAAAAAAEACAAABACAEAQAAEAgAAAEBAQABAgIECBAAAIIEEEECAEEAEIIQAghCEIIAgEIQhAIQAIRCIhARCAgAiIgIAIgAERAiAIAAIAAAEAAAAAAAAJAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca2.862 V1.902 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 12.089
b: 12.089
c: 12.089
alpha: 90
beta: 90
gamma: 90
cell_volume: 1766.734
crystal_density: 3.668
atoms_sites: ["Ca", "V", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAgGQCAA==
atoms_y: AAAAAAAAAAAAAAAAwOcCAA==
atoms_z: QEIPAAAAAABAQg8A0PgnAA==
atoms_occupancy: QDo6AGALOgAACT0AAAk9AA==
atoms_u_iso: 4HkAABBZAABgVAAAYLgAAA==
atoms_aniso_label: ["Ca", "V", "Si", "O"]
atoms_aniso_u11: gFcAABBZAACgQQAAwNoAAA==
atoms_aniso_u22: gIkAABBZAADAXQAAQJwAAA==
atoms_aniso_u33: gIkAABBZAADAXQAAQJwAAA==
atoms_aniso_u12: AAAAAGAJAAAAAAAAUPv//w==
atoms_aniso_u13: AAAAAGAJAAAAAAAAIOr//w==
atoms_aniso_u23: gIkAAGAJAAAAAAAAIAMAAA==
pub_title:
 The effect of fO2 on the partitioning and valence of V and Cr in garnet/melt
 pairs and the relation to terrestrial mantle V and Cr content
 Note: R090044

qdat:
AAAAAAAAAAAAAAAAAAAAAQAAEAAAAAAAIACAAACACAEAQAAEAgAAAIBAQABAgIECBAAAQIIEEEEAEEAIIQQAhCCEIQBAEIgiAIgAIhEIiAREBAAiIgIARAAIiBEAIAAIAAAIAAAAAAAARAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca3 (Cr1.15 Al.82 Ti.03) Si3 O12
compound: Saranovskiy mine, Sarany, Ural Mountains, Russia
formula_title: <missing>
a: 11.9204
b: 11.9204
c: 11.9204
alpha: 90
beta: 90
gamma: 90
cell_volume: 1693.840
crystal_density: 3.763
atoms_sites: ["Ca", "Cr", "Al", "Ti", "Si", "O"]
atoms_x: IKEHAAAAAAAAAAAAAAAAAGDjFgBAXgIA
atoms_y: AAAAAAAAAAAAAAAAAAAAAAAAAAAg2AIA
atoms_z: QEIPAAAAAAAAAAAAAAAAAEBCDwDg1CcA
atoms_occupancy: AAk9AGAYIwBABhkAYOoAAAAJPQAACT0A
atoms_u_iso: oCgAALBoAACwaAAAsGgAAAAyAAAAEnoA
atoms_aniso_label: ["Ca", "Cr", "Al", "Ti", "Si", "O"]
atoms_aniso_u11: 4BUAALBoAACwaAAAsGgAAEA4AACQlwAA
atoms_aniso_u22: ADIAALBoAACwaAAAsGgAAHAwAABwewAA
atoms_aniso_u33: ADIAALBoAACwaAAAsGgAAHAwAACAogAA
atoms_aniso_u12: AAAAAJABAACQAQAAkAEAAAAAAADQBwAA
atoms_aniso_u13: AAAAAJABAACQAQAAkAEAAAAAAADA+f//
atoms_aniso_u23: 8AoAAJABAACQAQAAkAEAAAAAAACwBAAA
pub_title:
 The effect of fO2 on the partitioning and valence of V and Cr in garnet/melt
 pairs and the relation to terrestrial mantle V and Cr content
 Note: R060477

qdat:
AAAAAAAAAAAAAAAAAAAAAEAABAAAAAAABAAQAAAIAQAgBAAAQCAAAAQEAgAEBAQIEBAAAQQIEEECACEAEEEIAQghCEEAQBCEQgCIACEQiIQCIgIAEREBABEAASICQAQAAQAAAQAAAAAAAASAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ca2.778 Mn.129 V1.62 Al.22 Cr.07 Si3 O12
compound: Tetitice, Klatovy, Czechoslovakia
formula_title: <missing>
a: 12.0276
b: 12.0276
c: 12.0276
alpha: 90
beta: 90
gamma: 90
cell_volume: 1739.951
crystal_density: 3.716
atoms_sites: ["Ca", "Mn", "V", "Al", "Cr", "Si", "O"]
atoms_x: IKEHACChBwAAAAAAAAAAAAAAAABg4xYAGGMCAA==
atoms_y: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAOO0CAA==
atoms_z: QEIPAEBCDwAAAAAAAAAAAAAAAABAQg8AqPgnAA==
atoms_occupancy: wIQ4AOCfAgBAcDEAwLYGAOAiAgAACT0AAAk9AA==
atoms_u_iso: MHUAADB1AAAgTgAAIE4AACBOAACAPgAAIIAAAA==
atoms_aniso_label: ["Ca", "Mn", "V", "Al", "Cr", "Si", "O"]
atoms_aniso_u11: 8FUAAPBVAAAgTgAAIE4AACBOAABQRgAAQIMAAA==
atoms_aniso_u22: YIYAAGCGAAAgTgAAIE4AACBOAADQOQAAsIEAAA==
atoms_aniso_u33: YIYAAGCGAAAgTgAAIE4AACBOAADQOQAAcHsAAA==
atoms_aniso_u12: AAAAAAAAAAAYAQAAGAEAABgBAAAAAAAAIAMAAA==
atoms_aniso_u13: AAAAAAAAAAAYAQAAGAEAABgBAAAAAAAAcP7//w==
atoms_aniso_u23: 4BUAAOAVAAAYAQAAGAEAABgBAAAAAAAAsAQAAA==
pub_title:
 The effect of fO2 on the partitioning and valence of V and Cr in garnet/melt
 pairs and the relation to terrestrial mantle V and Cr content
 Note: R061138

qdat:
AAAAAAAAAAAAAAAAAAAAAIAACAAAAAAACABAAAAgBACAIAACAIAAACAgIAAgIEBAgQAAECCBBBBABBABCCCAEIQghCAIAiCIQCEABEIhEQCIgEAEREBABEAAiIEQAgAAgAAAgAAAAAAABIAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Na.96 Si6 Al5.68 Mg2.001 Fe.635 Cr.315 Ni.158 V.031 Ti.039 B3 O31 H3
compound: Berezovskoe gold deposit, Middle Urals, Russia
formula_title: <missing>
a: 15.903
b: 15.9118
c: 7.2304
alpha: 90.063
beta: 89.793
gamma: 119.742
cell_volume: 1588.589
crystal_density: 3.100
pub_title:
 Dissymmetrization in tourmaline: the atomic arrangement of sectorally zoned
 triclinic Ni-bearing dravite

atoms_sites:
["Na1", "Sia", "Sib", "Sic", "Sid", "Sie", "Sif", "AlaY", "MgaY", "FeaY", "AlbY", "MgbY", "CrbY", "FebY", "AlcY", "MgcY", "CrcY", "NicY", "AlaZ", "MgaZ", "AlbZ", "MgbZ", "NibZ", "AlcZ", "MgcZ", "NicZ", "AldZ", "MgdZ", "VdZ", "FedZ", "TidZ", "AleZ", "MgeZ", "NieZ", "AlfZ", "MgfZ", "CrfZ", "B1", "B2", "B3", "O1a", "O2a", "O2b", "O2c", "O3a", "H3a", "O3b", "H3b", "O3c", "H3c", "O4a", "O4b", "O4c", "O5a", "O5b", "O5c", "O6a", "O6b", "O6c", "O6d", "O6e", "O6f", "O7a", "O7b", "O7c", "O7d", "O7e", "O7f", "O8a", "O8b", "O8c", "O8d", "O8e", "O8f", "Na1", "Sia", "Sib", "Sic", "Sid", "Sie", "Sif", "AlaY", "MgaY", "FeaY", "AlbY", "MgbY", "CrbY", "FebY", "AlcY", "MgcY", "CrcY", "NicY", "AlaZ", "MgaZ", "AlbZ", "MgbZ", "NibZ", "AlcZ", "MgcZ", "NicZ", "AldZ", "MgdZ", "VdZ", "FedZ", "TidZ", "AleZ", "MgeZ", "NieZ", "AlfZ", "MgfZ", "CrfZ", "B1", "B2", "B3", "O1a", "O2a", "O2b", "O2c", "O3a", "H3a", "O3b", "H3b", "O3c", "H3c", "O4a", "O4b", "O4c", "O5a", "O5b", "O5c", "O6a", "O6b", "O6c", "O6d", "O6e", "O6f", "O7a", "O7b", "O7c", "O7d", "O7e", "O7f", "O8a", "O8b", "O8c", "O8d", "O8e", "O8f", "Na1", "Sia", "Sib", "Sic", "Sid", "Sie", "Sif", "AlaY", "MgaY", "FeaY", "AlbY", "MgbY", "CrbY", "FebY", "AlcY", "MgcY", "CrcY", "NicY", "AlaZ", "MgaZ", "AlbZ", "MgbZ", "NibZ", "AlcZ", "MgcZ", "NicZ", "AldZ", "MgdZ", "VdZ", "FedZ", "TidZ", "AleZ", "MgeZ", "NieZ", "AlfZ", "MgfZ", "CrfZ", "B1", "B2", "B3", "O1a", "O2a", "O2b", "O2c", "O3a", "H3a", "O3b", "H3b", "O3c", "H3c", "O4a", "O4b", "O4c", "O5a", "O5b", "O5c", "O6a", "O6b", "O6c", "O6d", "O6e", "O6f", "O7a", "O7b", "O7c", "O7d", "O7e", "O7f", "O8a", "O8b", "O8c", "O8d", "O8e", "O8f"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

atoms_aniso_label:
["Na1", "Sia", "Sib", "Sic", "Sid", "Sie", "Sif", "AlaY", "MgaY", "FeaY", "AlbY", "MgbY", "CrbY", "FebY", "AlcY", "MgcY", "CrcY", "NicY", "AlaZ", "MgaZ", "AlbZ", "MgbZ", "NibZ", "AlcZ", "MgcZ", "NicZ", "AldZ", "MgdZ", "VdZ", "FedZ", "TidZ", "AleZ", "MgeZ", "NieZ", "AlfZ", "MgfZ", "CrfZ", "B1", "B2", "B3", "O1a", "O2a", "O2b", "O2c", "O3a", "O3b", "O3c", "O4a", "O4b", "O4c", "O5a", "O5b", "O5c", "O6a", "O6b", "O6c", "O6d", "O6e", "O6f", "O7a", "O7b", "O7c", "O7d", "O7e", "O7f", "O8a", "O8b", "O8c", "O8d", "O8e", "O8f", "Na1", "Sia", "Sib", "Sic", "Sid", "Sie", "Sif", "AlaY", "MgaY", "FeaY", "AlbY", "MgbY", "CrbY", "FebY", "AlcY", "MgcY", "CrcY", "NicY", "AlaZ", "MgaZ", "AlbZ", "MgbZ", "NibZ", "AlcZ", "MgcZ", "NicZ", "AldZ", "MgdZ", "VdZ", "FedZ", "TidZ", "AleZ", "MgeZ", "NieZ", "AlfZ", "MgfZ", "CrfZ", "B1", "B2", "B3", "O1a", "O2a", "O2b", "O2c", "O3a", "O3b", "O3c", "O4a", "O4b", "O4c", "O5a", "O5b", "O5c", "O6a", "O6b", "O6c", "O6d", "O6e", "O6f", "O7a", "O7b", "O7c", "O7d", "O7e", "O7f", "O8a", "O8b", "O8c", "O8d", "O8e", "O8f", "Na1", "Sia", "Sib", "Sic", "Sid", "Sie", "Sif", "AlaY", "MgaY", "FeaY", "AlbY", "MgbY", "CrbY", "FebY", "AlcY", "MgcY", "CrcY", "NicY", "AlaZ", "MgaZ", "AlbZ", "MgbZ", "NibZ", "AlcZ", "MgcZ", "NicZ", "AldZ", "MgdZ", "VdZ", "FedZ", "TidZ", "AleZ", "MgeZ", "NieZ", "AlfZ", "MgfZ", "CrfZ", "B1", "B2", "B3", "O1a", "O2a", "O2b", "O2c", "O3a", "O3b", "O3c", "O4a", "O4b", "O4c", "O5a", "O5b", "O5c", "O6a", "O6b", "O6c", "O6d", "O6e", "O6f", "O7a", "O7b", "O7c", "O7d", "O7e", "O7f", "O8a", "O8b", "O8c", "O8d", "O8e", "O8f"]

atoms_aniso_u11:

atoms_aniso_u22:

atoms_aniso_u33:

atoms_aniso_u12:

atoms_aniso_u13:

atoms_aniso_u23:

qdat:
AAAAAAAGAAAAAQEQIAAEggDACAQoAhpBCmCQhHgrkB0F0cgLRuCaFxPsEWs5fZ5WzNqc9epH5/+zx7/l5f6bZe/bef/h/97ecv384fe9z3/3/3J/tu93rv76/n/0Pn889w+/f7Zi/v9tffc+5v/fF+9b7hy2z1n/vjxdza==


formula: Ca3 Mn S2 O17 H12
compound: N'Chwaning III mine, Kalahari Manganese Field, South Africa
pub_title: Redetermination of despujolsite, Ca3Mn4+(SO4)2(OH)6*3H2O
formula_title: <missing>
a: 8.5405
b: 8.5405
c: 10.8094
alpha: 90
beta: 90
gamma: 120
cell_volume: 682.808
crystal_density: 2.546
atoms_sites: ["Ca", "Mn", "S", "O1", "O2", "O-h3", "OW4", "H1", "H2"]
atoms_x: kEgJAAAAAABVWBQAVVgUALDDDgCQmDYA4I0eAIAGMwCgzB8A
atoms_y: 4IUSAAAAAACrsCgAq7AoAFAzHQBg5QUA0J4dACChBwAgKRsA
atoms_z: QEIPAAAAAACAjQEAWDH5/7g0BACwwQYAQEIPAICjBACgxwsA
atoms_occupancy: 0
atoms_u_iso: iKkAADCEAABAkgAA8AQBAMAlAQBQqgAAMAsBAECWAQDAzgIA
atoms_aniso_label: ["Ca", "Mn", "S", "O1", "O2", "O-h3", "OW4"]
atoms_aniso_u11: ENYAAJiPAABonAAA0EwBAOClAQBAgwAA4CgBAA==
atoms_aniso_u22: cI8AAJiPAABonAAA0EwBAKClAABA5wAAYGcBAA==
atoms_aniso_u33: IJkAAGBtAACQfgAAMHUAAKAJAQAwpwAAgNQAAA==
atoms_aniso_u12: oFoAAOBHAABITgAAMKcAAAB9AACwaAAAoNcAAA==
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAIA+AACg9v//AAAAAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAJAzAADA+f//AAAAAA==
qdat:
AAAAAAAAAAAAAAQAAQAIAAAAkAAAIAgQIAIAAECACQUEABCEggEkiBCASERBASESXCACSYJUhMEm0MFEq4EQplyRIxFCFbFglpxSjwkpilVJCWOkZqphq8BGyqeVZjVpVbaSiwRqPRWFVE0mtiKzVXay30VjZmxF7k6NUp==


formula: Al2 P S O18 H19
compound: Pensylvanian slates belonging to Los Jejenes Formation at the
formula_title: <missing>
a: 13.9163
b: 17.2422
c: 6.1125
alpha: 90
beta: 98.255
gamma: 90
cell_volume: 1451.484
crystal_density: 1.941
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:
 Sanjuanite: Ab Initio crystal-structure solution from laboratory
 powder-diffraction data, complemented by FTIR spectroscopy and DT-TG analyses
 Pocito Department, San Juan Province, Argentina

atoms_sites:
["Al1", "Al2", "P", "S", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O-H9", "Wat10", "Wat11", "Wat12", "Wat13", "Wat14", "Wat15", "Wat16", "Wat17", "Wat18"]

atoms_x:
0Er5/5AKCwDAZQcAALcHAKB0BADQDwcAgBwOAIDoBQAgpwYA0N4KAECvAQBAqwoAUM32/6At+/8AKPH/AEP5/4CUEwDQ3AIA0B0NALDx/v/Aufn/UKISAA==

atoms_y:
sAwHAAAzBABw0wIAsBwVAMCbFwCwKRcAYFMVADAVEADwZ/3/oAoFACAqBgCwVgMAcG8CAFAXDAAQdAgAoMcLAMAyAwCQDwYAYPkKAEAkFAAAihsAQNcLAA==

atoms_z:
gEckAKDBDADw1ikAoFoZAND9IgDgmwsAsEQfAEAlGABQCycAIFwfAGCQKACQczgAcDwwAADnGADAqR0AEPUxAIADDgAwkAgAQFoLAFACNQAQaQ4AkNUwAA==

atoms_u_iso:
aCsDAGgrAwBoKwMAaCsDAGgrAwBoKwMAaCsDAGgrAwBoKwMAaCsDAGgrAwBoKwMAaCsDAGgrAwBoKwMAaCsDAGgrAwBoKwMAaCsDAAiSBgAIkgYACJIGAA==

qdat:
AAAAAAACACAAQAIQIAIGBQBKIdAkCRG4DIi0Oyk1ZMYz8Tk2ya7Guf34+9f+z+vVfnu1/e/y7857/n4tW/uz8f9//pT/1/t3uf/O21Ov//rd2H6tf/7fuv8d+/PdP+Xrt3ubfvfFi/Pr7vm/q0+bl/VXs/Ctdfv332l+vR==


formula: Na4 Mg V10 O51.82 H47.64
compound: Synthetic
pub_title: The crystal structure of the elusive huemulite
formula_title: <missing>
a: 9.0425
b: 11.3303
c: 11.7353
alpha: 105.222
beta: 97.377
gamma: 100.791
cell_volume: 1119.459
crystal_density: 2.229
atoms_sites:
["Na1", "Na2", "Na3", "Mg1", "V1", "V2", "V3", "V4", "V5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "OW1", "H1A", "H1B", "OW2", "H2A", "H2B", "OW3", "H3A", "H3B", "OW4", "H4A", "H4B", "OW5", "H5A", "H5B", "OW6", "H6A", "H6B", "OW7", "H7A", "H7B", "OW8", "H8A", "H8B", "OW9", "H9A", "H9B", "OW10", "H10A", "H10B", "OW11", "H11A", "H11B", "Wat12A", "Wat12B"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

atoms_aniso_label:
["Na1", "Na2", "Na3", "Mg1", "V1", "V2", "V3", "V4", "V5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "OW1", "OW2", "OW3", "OW4", "OW5", "OW6", "OW7", "OW8", "OW9", "OW10", "OW11", "Wat12A", "Wat12B"]

atoms_aniso_u11:
YC8CAOADAwAg9wEAYIABAIC1AQCguAEA4FoBAIjHAABAZAEAALwCAPAdAQBgsgEAcG8CAMC7AQDQ6AAAkNwBAICcAQAg/QAAAPQBAIB9AgBQIQIA0AEBABAhAQDA5wIAMMEEAPARAwCwmwQA8BcCAEDhAQBQ1gEAAA0CAACjAgBArwEAQH0BAEABBQCgdAQA

atoms_aniso_u22:
EOMCAPDfAgCgAwIA0MkBAIApAQDwTwEAYPQAACj/AAD4MwEAkMMBAABeAQCAgwEAwFcBAHD4AAAwPQEAQH0BAMBXAQBw+AAAEOkBANAUAgAwoQEAIP0AAJB4AQDA7QEAcLoCAJA6AwCQ1gIA4CICAIDnAQDg8AEAcKECANByAwBA2wIAYCkDAEDpCABgTwUA

atoms_aniso_u33:
sK0BAJByAgBgLwIAgOcBANAzAQAwugEAYGcBACg7AQA4/gAAANsBACCsAQBgHAEA0H4BAICcAQBAZAEAYGcBABA0AgDwNgEA8LMBACDYAgAwaQIA4CgBAKDqAQAwYwMAIAoDAIDnAQBwfAQAMM0CAADVAgAATAQAMLQCAHA3AwAAcQIAMBgDAGBPBQAgrQUA

atoms_aniso_u12:
0DkAADAkAQCQyQAAkOIAAPAjAACgcwAAWIQAAGh0AACoegAAIAMAAGCGAABQXwAA4BUAADBcAADAqAAAcJQAABC9AACgcwAAoAkBAPDSAABAMgEAAGQAAMCoAACAogAA0LYAABDvAACwxgEAQAABAIAfAQBwjgEAMKcAABA0AgCwrQEAYMsBAGDkAQBg8P//

atoms_aniso_u13:
oEEAAEAZAQBQXwAAUKoAANAbAACIAwEAIHEAAJg/AADgQgAA0NX//3AXAADw8f//ENYAADB1AABQLQAAIMsAAJD7AABAUQAAYFQAABDQAQAQvQAAQFEAAICiAADA8wAAUKQBAJD7AAAw/wIAUKoAACDLAAAA4QAAwHYAABDpAQBAzgAAcEkAAKCMAABgc///

atoms_aniso_u23:
YIz//1D1AABAUQAAUJEAAIDa//+4fgAA6FgAAPAeAABgLAAAYHP//wDn///g4///IDUAAAAZAABwMAAAwF0AACCyAACAJQAAkEwAAHDfAAAgywAAUC0AAIBXAAAwjgAAIGEBAACWAAAwugEAcK0AAKAoAACgcwAAsLMAALCUAQDw0gAAwF0AAOCZAwBg5AEA

qdat:
AAAAAAAAAJAAgAAECQBCAAgCwIAIwmAhGUIAgSJMICSXTBkuoSD2FJbQ3iU9xBm1q58vH+Zw/2btdX1vvf59v37/e/z7//b9z/9M//s+P3/ruf+jb/377/+j9/73///3f//l/v/fP/7vf7n//+++/3/fzf/r3R/7frVO/f==


formula: Na4 Mg V10 O51.72 H47.44
compound: West Sunday mine, Utah, USA
pub_title: The crystal structure of the elusive huemulite
formula_title: <missing>
a: 9.0453
b: 11.3337
c: 11.7372
alpha: 105.223
beta: 97.383
gamma: 100.790
cell_volume: 1120.298
crystal_density: 2.225
atoms_sites:
["Na1", "Na2", "Na3", "Mg1", "V1", "V2", "V3", "V4", "V5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "OW1", "H1A", "H1B", "OW2", "H2A", "H2B", "OW3", "H3A", "H3B", "OW4", "H4A", "H4B", "OW5", "H5A", "H5B", "OW6", "H6A", "H6B", "OW7", "H7A", "H7B", "OW8", "H8A", "H8B", "OW9", "H9A", "H9B", "OW10", "H10A", "H10B", "OW11", "H11A", "H11B", "Wat12A", "Wat12B"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

atoms_aniso_label:
["Na1", "Na2", "Na3", "Mg1", "V1", "V2", "V3", "V4", "V5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "OW1", "OW2", "OW3", "OW4", "OW5", "OW6", "OW7", "OW8", "OW9", "OW10", "OW11", "Wat12A", "Wat12B"]

atoms_aniso_u11:
YHoCANBZAwBgSAIAYLIBAMAGAgDgCQIAoJ8BAHARAQAgrAEAAO4CALBJAQAw7AEAELECACAQAgAQIQEAICkCACDeAQCAUQEAYC8CALDAAgBgYQIAUIsBANBlAQCwbwMAYE8FAHBpAwAQ1wQAUFMCABA0AgAwHgIA0MMCAJDWAgDg1wEAkNwBAEB+BQAgMAUA

atoms_aniso_u22:
QA0DAFACAwDQLQIAUO8BAPBPAQDQfgEA8B0BAMAlAQAgYQEAsPgBANCXAQCguAEA0H4BAAAsAQDQZQEAMKEBAGBnAQCQFAEAACYCAJBAAgBQvQEAgB8BAMCiAQBgFgIAINgCAEA/AwDgAwMAUFMCAJD1AQDgIgIAwLUCAGCNAwBADQMAsFYDAICFCQCgaAYA

atoms_aniso_u33:
IN4BAEDCAgBQbAIAEDQCAGCAAQDw/gEAsK0BAEB9AQAgSAEA4CICAGDLAQCAOAEAAMIBAEAsAgDgpQEAoJ8BACCNAgCgnwEA8OUBAIATAwAwggIAEIUBAJAOAgCwoQMAYFsDABBmAgDAwgQAEBUDAMAZAwBgoAQA0MMCALChAwDQqgIAwEsDAIAaBgDgBAcA

atoms_aniso_u12:
sE8AAJBGAQCA7QAAUA4BAMBEAACwmgAAoKUAAFCRAABAnAAAIBwAAHCUAABQeAAAYDsAAACWAAAQvQAAILIAAPDSAAAgmQAAMCQBALD+AAAARQEAgIkAAGDRAABw3wAAoNcAAPAEAQCQ9QEAsBcBACAvAQDgpQEAwKgAABBNAgBgsgEAEOkBAECQAgCAOAEA

atoms_aniso_u13:
0FIAACAvAQBAagAAAK8AAOAuAACwFwEA8IcAAOBRAAAwXAAAQNT//zARAACw6///IOQAAHCtAADwPAAA8OsAAJD7AACwgQAAMFwAAEDhAQCQsAAAoIwAAIC7AABQJwEA4NcBAFAnAQBgKQMAAMgAAADhAADQ6AAA4MQAADDsAQCA1AAAkGUAAGDqAADgqwAA

atoms_aniso_u23:
EJH///AEAQAwXAAAsJoAAADn//8wjgAA2GMAACgoAACANAAAwGP//3Dl//8g6v//YFQAACAcAACwNgAAwF0AAPCgAAAQJwAAIE4AAGADAQAQvQAAcEkAAEBqAABwxgAAQJYBAJCXAABQ1gEAcK0AABBAAADQhAAAQM4AAPCaAQDw0gAAYIYAAECKAwCgegMA

qdat:
AAAAAAAAAJAAgAAEEQBCAAgCwIAIwmAhGUIAgSZMICSXTBkuoSD2FJbQ3ik9xBm1q58rH6Zw/2b99Xnvvf593373W/n7//T5z/+M//M+P3/buf/jb/X3+/+j///3///3///t+v/fb//v/7v77+++/2//3/+r3T3//u1O2f==


formula: Na.88 Ca.88 Pb.02 (Ta1.7 Nb.14 Si.12 As.04) O6 F.73 H.24
compound: Morro Redondo mine, Coronel Murta, Minas Gerias, Brazil
formula_title: <missing>
a: 10.4396
b: 10.4396
c: 10.4396
alpha: 90
beta: 90
gamma: 90
cell_volume: 1137.762
crystal_density: 5.800
atoms_sites: ["NaA", "CaA", "PbA", "TaB", "NbB", "SiB", "AsB", "O1", "O-H1", "F"]
atoms_x: gIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAMAsBADALAQAYOMWAA==
atoms_y: gIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAGDjFgBg4xYAYOMWAA==
atoms_z: gIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAGDjFgBg4xYAYOMWAA==
atoms_occupancy: ANsaAADbGgBAnAAAQOEzAMBFBACAqQMAgDgBAACYOgAAcQIAQI4sAA==
atoms_u_iso: 0BoBANAaAQDQGgEA4MQAAODEAADgxAAA4MQAAHBDAQBwQwEAIMsAAA==
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 crystal structure of a microlite-group mineral with a formula near NaCaTa2O6F
 from the Morro Redondo mine, Coronel Murta, Minas Gerias, Brazil

qdat:
AAAAAAAAAAgAAAQAAIAAgAEAEAAAIAQCAICAQEAAQIECBAggAQQQQAggCCEIQhAEQhEIgERCIiAiIgIgJESIgSJEiCJIkgiSCIJJJIJJRQCUkhJISEpSQpKUJSFCVAQKlQhUoFTIERIiBRQQgiIJAAFEgAgAIgIAAAIgAA==


formula: Ca H B O3
compound: Synthetic
formula_title: <missing>
a: 3.5624
b: 9.5225
c: 8.6231
alpha: 90
beta: 119.452
gamma: 90
cell_volume: 254.718
crystal_density: 2.605
atoms_sites: ["Ca(1)", "H(1)", "B(1)", "O(1)", "O(2)", "O(3)"]
atoms_x: cLweAECi//9QkwgAEAQKACBDBgAg0wcA
atoms_y: 0BYeAGAjNgAwbA4AICgXANBOCQDQLwoA
atoms_z: wH0rAEBAOQCg8BkAYAMaAMC/EQDwnCIA
atoms_occupancy: 0
atoms_u_iso: ABJ6AOAiAgAAEnoAABJ6AAASegAAEnoA
atoms_aniso_label: ["Ca(1)", "B(1)", "O(1)", "O(2)", "O(3)"]
atoms_aniso_u11: 8KAAAIBXAACQyQAAYNEAACCsAQA=
atoms_aniso_u22: 8KAAABDvAADwhwAA0LYAAMCoAAA=
atoms_aniso_u33: 0LYAAOCSAABwrQAAMMAAACD9AAA=
atoms_aniso_u12: wPn//+D8///QBwAAUOL//xAnAAA=
atoms_aniso_u13: gFcAALA2AADwVQAAEHIAAODdAAA=
atoms_aniso_u23: MPj//3D+//+w6///INH//zAqAAA=
pub_title:
 Hydrothermal synthesis and single-crystal X-ray structure refinement of
 three borates: sibirskite, parasibirskite and priceite
 Note: T = 295 K

qdat:
AAAAAAAAAAAAAAAAABAAAAgAAAgBAAgAABAFAAAAIAAZgAQZAAAAgKEFDCAAiSCAFAoEE4EiAQQQSQdACRMCpEM3highJLckgrQAx5JjUgHWAupi0OE5oP2rlU0sIN2agjbMioXuDq/tlblZYlW6T15TaLO0TjZb4/dYtD==


formula: Ca H B O3
compound: Synthetic
formula_title: <missing>
a: 6.6994
b: 5.4269
c: 3.5534
alpha: 90
beta: 93.048
gamma: 90
cell_volume: 129.008
crystal_density: 2.572
atoms_sites: ["Ca(1)", "H(1)", "B(1)", "O(1)", "O(2)"]
atoms_x: YIUVAEAr/v8wvQ0AwHABAEB1EwA=
atoms_y: QEIPAGCsNADAxi0AwMYtAGB1IAA=
atoms_z: yCgPAMByOwCABS8AQD81APD2LAA=
atoms_occupancy: AAk9AICEHgAACT0AAAk9AAAJPQA=
atoms_u_iso: ABJ6AADuAgAAEnoAABJ6AAASegA=
atoms_aniso_label: ["Ca(1)", "B(1)", "O(1)", "O(2)"]
atoms_aniso_u11: sLMAAMCPAACwswAAYDUBAA==
atoms_aniso_u22: gHAAAACvAADQyQEA0IQAAA==
atoms_aniso_u33: 4JIAAICJAAAg9wEA8LkAAA==
atoms_aniso_u12: AAAAAAAAAAAAAAAA4Pz//w==
atoms_aniso_u13: aBAAAOD8//+gcwAAoCgAAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAUPv//w==
pub_title:
 Hydrothermal synthesis and single-crystal X-ray structure refinement of
 three borates: sibirskite, parasibirskite and priceite
 Note: T = 295 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAAABAAAAEAIAAQIBACQACAAQAAgUCBEAAAABACghBSABlAQKAGgBUEAAYNBGgCIKYEQMkLIBEgFOaFIlFIgSDQaAVIahUF1zOwWicBDQ4qUKqx2ExqriRu6Bq0iEn+cNy2IOrWzVesOv9x5uY==


formula: Ca H B O3
compound: Synthetic
formula_title: <missing>
a: 6.6798
b: 5.4208
c: 3.5466
alpha: 90
beta: 93.245
gamma: 90
cell_volume: 128.216
crystal_density: 2.588
atoms_sites: ["Ca(1)", "H(1)", "B(1)", "O(1)", "O(2)"]
atoms_x: AIYVAECi//8grw0AsGIBACByEwA=
atoms_y: QEIPAGAjNgDAxi0AwMYtAEByIAA=
atoms_z: GBoPAEBAOQCg7y4A8EM1ABDhLAA=
atoms_occupancy: AAk9AICEHgAACT0AAAk9AAAJPQA=
atoms_u_iso: ABJ6AOAiAgAAEnoAABJ6AAASegA=
atoms_aniso_label: ["Ca(1)", "B(1)", "O(1)", "O(2)"]
atoms_aniso_u11: QGoAAGBUAAAQcgAAAMgAAA==
atoms_aniso_u22: 0FIAAACvAABAfQEAUF8AAA==
atoms_aniso_u33: oFoAAKBBAABwQwEAAH0AAA==
atoms_aniso_u12: AAAAAAAAAAAAAAAAwPn//w==
atoms_aniso_u13: WAwAAFD7///QOQAAUBQAAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAUPv//w==
pub_title:
 Hydrothermal synthesis and single-crystal X-ray structure refinement of
 three borates: sibirskite, parasibirskite and priceite
 Note: T = 173 K

qdat:
AAAAAAAAAAAAAAACAAAAAAAABAAAAEAIAAQIBACIACAAIAAQKBBCAAAAAgBQwgxAAigIFADQA1CAAKHAhIDIFMCGCiFiAiQByrBSJlVIFAwFgFSCwYhXMi8LZDAo8SSykxyXSkLK4hNuwpcwok/vBeflDLUs9vdh5mOkn3==


formula: Ca2 O13 B5 H7
compound: Synthetic
formula_title: <missing>
a: 11.580
b: 6.9844
c: 12.352
alpha: 90
beta: 110.573
gamma: 90
cell_volume: 935.309
crystal_density: 2.480
atoms_occupancy: 0
pub_title:
 Hydrothermal synthesis and single-crystal X-ray structure refinement of
 three borates: sibirskite, parasibirskite and priceite
 Note: T = 173 K

atoms_sites:
["Ca(1)", "Ca(2)", "OW(1)", "B(1)", "B(2)", "B(3)", "B(4)", "B(5)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "O(10)", "O(11)", "O(12)", "H(1)", "H(2)", "H(3)", "H(4)", "H(5)", "H(6)", "H(7)"]

atoms_x:
AH0AANDWEgBwDB8AoDIPANAaAQDQQgsAgIESALCxEQAAiBMAcCgSADBHEAAwGQcAIL7+/9B2+v8gVQMAEPIMADAtDADgSxAAwOAYAAA3FABQRx0AwB0TAICsDwCwxPn/MLj5//DUIQAAhSAA

atoms_y:
OD8uAFDnDgCQMhUAQLotAPBHLAAAniAAoCYRADDcJQDQHy4AYOU3ADDVIgAw0i8A4Ho2AMAWKQBAfyIAIO4oANBwFAAQLwcAgBYPAHCOGgBgzg0AILIAAIDJOAAAIDUAgFkhAOAZEABAcRwA

atoms_z:
eGQjABgcFwDgGxgA0JwVAEALFAAwXR0AcEYmAIAjKgDAVi8AYIAaAJB+GQDAdBEA4J4XAADFDQAgAxkAMIQjAHDUHwBAoCkAsPQjAMCgKwDA1yYA8BsrAKCmHQCwEBcAEFAOAADbGgDgZhgA

atoms_u_iso:
ABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AABkAAAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegAAEnoAABJ6AAASegCAqQMA4CICAGDeAgBg2AMAAO4CAEANAwBADQMA

atoms_aniso_label:
["Ca(1)", "Ca(2)", "OW(1)", "B(1)", "B(2)", "B(3)", "B(4)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "O(10)", "O(11)", "O(12)"]

atoms_aniso_u11:
UHgAANCEAACQyQAAIE4AAAB9AACgjAAAoIwAANCdAACAogAAIIAAAGCGAADgkgAAwHYAADCnAAAQiwAAkJcAAGCfAACQZQAAkMkAAA==

atoms_aniso_u22:
oFoAAABkAADAogEAQJwAAMBdAAAgTgAAoIwAAKBaAACwaAAAoHMAAFCRAABQkQAAIGcAAJBMAABQXwAAsE8AAMBdAAAA4QAA0FIAAA==

atoms_aniso_u33:
UF8AAOBgAADwHQEAAH0AAOBHAABgbQAAECcAAKBaAAAQiwAAAEsAAFB4AABQqgAAQGoAAEBqAABQXwAAIE4AAICJAADgkgAA8G4AAA==

atoms_aniso_u12:
4Pz//5ABAADQo///QO3//2AJAACw6///YPD///Dx//9Q+///QAYAAEAGAAAQ9f//MPj//7Dr///wCgAAMPj//9AHAACQMwAA8AoAAA==

atoms_aniso_u13:
wCsAAOAuAAAwQwAAwCsAAJABAACgKAAAoA8AANBSAADAKwAAsB0AALA2AADAXQAAsAQAAIA+AAAwKgAAABkAAPAjAAAwKgAAcEkAAA==

atoms_aniso_u23:
YAkAABD1//+gKAAAYNf//0Dt//8w3///AAAAAODj//8Azv//MBEAAMBEAAAwEQAAoA8AADARAADg/P//MBEAADAqAABABgAAQAYAAA==

qdat:
AAAAAAAAACAAAAAAAFQIAEAMEAACIghsCCQyUAmQGOgqBRimtoOiUGM1vTkb6FzvP/nLXp2eFrgf9/+FM0v68qv0+98P/9vv//6kX6vF9/+uP/+71/v9///u9+/////vff///e7/f7/v/e/bb+74+z///9tt//m3PyXMv9==


formula: Mg3.976 Fe1.404 Ti.42 Al.2 B2 O10
compound: Tazheran massif
formula_title: <missing>
a: 9.260
b: 12.294
c: 3.0236
alpha: 90
beta: 90
gamma: 90
cell_volume: 344.214
crystal_density: 3.687
atoms_x: AAAAAMASAACAhB4AgIQeAFiKDgBYig4AWIoOAFiKDgBYig4AoMIQADBbFQDwrgYAwJcHAOBsFwAQWBUA
atoms_y: AAAAAOgfEQAAAAAAAAAAACALBwAgCwcAIAsHACALBwAgCwcAIPwVADDmGwDQuAgAUNsVAKCmBAAABBAA
atoms_z: gIQeAICEHgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AAAAAAICEHgAAAAAA
atoms_occupancy: AAk9AAAJPQCAxhMAgEIpAMCvHABA0QwAwCcJAIAaBgDARQQAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 4GAAABBZAAAQQAAAEEAAAKBpAACgaQAAoGkAAKBpAACgaQAAMFwAAJBlAABAgwAAgHAAAHCUAADQawAA
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:
 Cation distribution in the structure of titanium-containing ludwigite
 Note: to be the mineral azoproite, Ti+Mg must be greater than Fe3+ in M4 site
 Note: Uiso values have been divided by 100

atoms_sites:
["MgM1", "MgM2", "Fe2+M3", "MgM3", "Fe3+M4", "Ti4+M4", "MgM4", "AlM4", "Fe2+M4", "B", "O1", "O2", "O3", "O4", "O5"]

qdat:
AAAAAAAAAAAAAAQAAgAAEACAQAAAoAAAAAyhAIiARIUAmQgA6RAYoEFBiyA8CJ1BEBpBepnZXIHBXehi8xWXNwzYV1fi3gy2f9sy4I/xFtufrv+CVftX5p+kL6lWfKKLniYy3uZoX7lM7t7SYvmrhbWNEXdSoeiJqjmwWe==


formula: Ni3 P2 O16 H16
compound: Synthetic
pub_title: Poly[octaaquadi-mu-phosphato-tri-nickel(II)]
formula_title: <missing>
a: 9.963
b: 13.225
c: 4.6406
alpha: 90
beta: 104.730
gamma: 90
cell_volume: 591.353
crystal_density: 2.865
atoms_sites: ["Ni1", "Ni2", "P1", "O1", "O2", "O3", "O4", "O5", "H1", "H2", "H3", "H4"]
atoms_x: AAAAAICEHgAI0ykAwHAzAODmJACgACgA4PEFAMAxGACAXwcAoIIKABDoFgCAGRsA
atoms_y: AAAAAEi2BgAAAAAAAAAAAAAAAAC4DPr/6PcGAGiPDQCgbgUAADQIAGCJDADw1hAA
atoms_z: gIQeAICEHgAQFgcAUIAHALD3LwAghBAAAPISACCWDQAg4AkA0DMaAOBtAgAwIQ4A
atoms_occupancy: 0
atoms_u_iso: MKcAABCkAADgkgAAcMYAAHCtAABwxgAAkOIAAKAJAQDAVwEAwFcBAKCGAQCghgEA
atoms_aniso_label: ["Ni1", "Ni2", "P1", "O1", "O2", "O3", "O4", "O5"]
atoms_aniso_u11: MI4AAPCgAADQawAA0GsAALCaAACQyQAA8LkAAMA+AQA=
atoms_aniso_u22: gKIAAPCHAABAnAAA4A8BAOCSAACgvgAAMAsBAHDfAAA=
atoms_aniso_u33: sLMAANC2AAAQpAAAcMYAAHDGAABwxgAAcN8AACDkAAA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAwEQAA8PH//5AaAAA=
atoms_aniso_u13: 8AoAAHAXAABgCQAAsAQAAGAJAACgKAAAwCsAAHAXAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAADA+f//MPj//xAnAAA=
qdat:
AAAAAAAAAAAAAEABAAAAACAIAARAQQACAEACBAIoIgAEAIKGEICYQhJBMAEOAARJdQC+CAgW2SiiPKaSmgUGXqBKMKLKmZbMj1UUD3KgVGmULlE2FeCAj3XLxj4A6jyDqSCkXUdIiSY3xyHOIkR5OENXQOFA3GADZ0RpoI==


formula: (Cu.889 As.111)
compound: Synthetic
pub_title: The copper/arsenic system and the copper arsenide minerals
formula_title: <missing>
a: 2.588
b: 2.588
c: 4.226
alpha: 90
beta: 90
gamma: 120
cell_volume: 24.513
crystal_density: 8.781
atoms_sites: ["Cu", "As"]
atoms_x: VVgUAFVYFAA=
atoms_y: q7AoAKuwKAA=
atoms_z: QEIPAEBCDwA=
atoms_occupancy: oEI2AGDGBgA=
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAEAABAAAAAAAAAAAAAAAQAAAAAAAAAAAAgAAAAABAAAAAEAgCAAQAAAAABAAAEAAAAAAAAAIAAACAAQAgAAAEQAAQAAAQAAAIAAACAAAAAARAAEAABAAAA==


formula: (Cu.9 As.1)
compound: Synthetic
pub_title: Einige strukturelle Ergebnisse an metallischen Phasen II
formula_title: <missing>
a: 2.59
b: 2.59
c: 4.24
alpha: 90
beta: 90
gamma: 120
cell_volume: 24.632
crystal_density: 8.721
atoms_sites: ["Cu", "As"]
atoms_x: VVgUAFVYFAA=
atoms_y: q7AoAKuwKAA=
atoms_z: QEIPAEBCDwA=
atoms_occupancy: gO42AIAaBgA=
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAIAABAAAAAAAAAAAAAAAgAAAAAAAAAAABAAAAAAEAAAAAICACABAAAAAACAAAQAAAAAAAAAQAAAEAAgCAAAAggAAgAAAQAAAgAAAUAAAAABIAAQAACAAAA==


formula: Fe Cl2
compound: Synthetic
formula_title: <missing>
a: 3.58
b: 3.58
c: 17.54
alpha: 90
beta: 90
gamma: 120
cell_volume: 194.682
crystal_density: 3.243
atoms_sites: ["Fe", "Cl"]
atoms_x: AAAAAAAAAAA=
atoms_y: AAAAAAAAAAA=
atoms_z: AAAAAEBCDwA=
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
pub_title:
 Etude par diffraction de neutrons a 4.2 K de la structure antiferromagnetique de Cl2Fe
 Note: T = 4.2 K

qdat:
AAAAAAAAAAAAAAAAABAAAAAAAAAAAAAAAAIBAAAAAIAAAQAAAAAAACAAAAEAAQAAAAABCAACABAAAAAEAACAAAAAAEQAEAQAAACAAIAgAAAEAAAAAACAAgIAAAoAQIAABABAAAAKAQIAAIAIAAAKAQIAAgBBAABAAAABAA==


formula: Fe2 S.5 O7 H5
compound: Fornovolasco, Tuscany, Italy
formula_title: <missing>
a: 16.068
b: 3.058
c: 10.929
alpha: 90
beta: 93.82
gamma: 90
cell_volume: 535.814
crystal_density: 3.034
atoms_sites: ["Fe1", "Fe2", "S", "O1", "O2", "O-H3", "O-H4", "O5", "Wat5", "O-H6", "O7", "Wat7"]
atoms_x: MCISAIDRDQCg8R0AgL8QAFD9IADwOAkAQFoLAEDOGQBAzhkAYGUSAPARHADArxwA
atoms_y: AAAAAICEHgAAAAAAgIQeACDtJAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
atoms_z: 8PcXALCiBwDwNBIAgKARAFDOEwBwrwgAwOEcAACiFwAAohcA4BYEAEBgCgCg8QQA
atoms_occupancy: AAk9AAAJPQCAhB4AAAk9AICEHgAACT0AAAk9AICEHgCAhB4AAAk9AICEHgCAhB4A
atoms_u_iso: wNoAAMDaAADAVwEA4CgBAGDkAQCAOAEAoAkBAEATAgBAEwIAIEgBAGDkAQBg2AMA
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:
 Volaschioite, Fe3+4(SO4)O2(OH)6*2H20, a new mineral species
 from Fornovolasco, Apuan Alps, Tuscany, Italy

qdat:
AAAAAAAAACAAAgAACAAQAAAAgAQAFAAAEEBAIAIUwoAAFEAJiCSBQCAA3SECgYIQhIDKk6FTEaYJVAlloBCKhUUlPlEigCKHxNYQeQCld8UlphoLcxOSBC9rlASUGiICSQEkEKCAErolhgPyQxiQ9FQWOEDKAkjAoAhRAg==


formula: Ca2 Fe1.513 Mn.21 Mg.197 Al.08 Si5 H O15
compound: Arvigo, Val Calanca, Grisons, Switzerland
formula_title: <missing>
a: 7.469
b: 12.161
c: 6.675
alpha: 86.09
beta: 93.94
gamma: 112.21
cell_volume: 559.398
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
pub_title:
 Cation distribution in Mg, Mn-bearing babingtonite from Arvigo,
 Val Calanca, Grisons, Switzerland
 Note: Sample Arvigo 1, NMBE 34973

atoms_sites:
["Cal", "Ca2", "Fe1", "Mn1", "Mg1", "Fe2", "Mg2", "Al2", "Sil", "Si2", "Si3", "Si4", "Si5", "H1", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15"]

atoms_x:
YM0JANA8EQBYDgMAWA4DAFgOAwBAfQsAQH0LAEB9CwCAui4AkA40ACD6JgBwVCwAcAwfAICVMAAAJTAAIAU6AOABLQDQTAEAsFAEAKA/KgCgWhkAsKYwADA6JwCw7DUAgCgMAECLIAAwpREA8IwUAIACIwA=

atoms_y:
+H05ALi+HwAgSicAIEonACBKJwBwXg4AcF4OAHBeDgDYPQMAiB4TAJAnGwDwiSsAuPsyAEBGOABQPDwA0OkEAOBvCgBAoRQA4OAlAICbFgCwdBcAUPwcAECxIgDgFC4A0IENABD6LACQvDAA0LgIAOAROwA=

atoms_z:
UFM0AFB2KgAQUjkAEFI5ABBSOQDwyTEA8MkxAPDJMQAgPygAgBsjACBBMACQGCoAUJI2AMCpHQCwbxwA4MoxAIBTIgCACy4AAMUmAKA+JgAgejMA8Go7ABBjKABgdDUA0N0fAPC+LQCAqjkAQPs3AFBYLwA=

atoms_occupancy:
AAk9AAAJPQBgACcAQNEMAGA3CQBAWDUAwM4CAADiBAAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
QKYAAAiOAADYaAAA2GgAANhoAABoVgAAaFYAAGhWAADYaAAA+FwAABhbAAAYWwAA2GgAAEh5AgD4xQAAmIoAAGCaAACohAAAcJQAAJiKAACYigAAiIYAAKCCAACYigAAWKIAAIiQAABQoAAAaJwAAECmAAA=

qdat:
AAAAAAAAAIAAAAASAAiAEAIBAAgAgAIEUABFERCFAQQASUEXNCpBSCVx0LRVCDB5bUcyDDDep0MHOL3NhPeL2udheP95u2Nse749n/mPfden1r+/8uem2/+3F/avP/+nN3e+X65vn3u2f/q/t//7u/9fvf+/f//veq37/9==


formula: Ca2 Fe1.366 Mn.26 Mg.344 Al.03 Si5 H O15
compound: Arvigo, Val Calanca, Grisons, Switzerland
formula_title: <missing>
a: 7.480
b: 12.159
c: 6.678
alpha: 86.10
beta: 93.92
gamma: 112.08
cell_volume: 560.911
crystal_density: 3.324
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:
 Cation distribution in Mg, Mn-bearing babingtonite from Arvigo,
 Val Calanca, Grisons, Switzerland
 Note: Sample NMBE 34974

atoms_sites:
["Cal", "Ca2", "Fe1", "Mn1", "Mg1", "Fe2", "Mg2", "Al2", "Si1", "Si2", "Si3", "Si4", "Si5", "H1", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "Ol0", "O11", "O12", "O13", "O14", "O15"]

atoms_x:
IJUJAPBJEQBwFAMAcBQDAHAUAwDohAsA6IQLAOiECwCwyy4A8Bc0AJD4JgDATywAYP4eAED5LwDQLDAAEBA6AIARLQDwTwEA8FYEADBBKgAwXBkAYJIwALBGJwAA6DUAADUMACCIIAAQohEAoKoUALATIwA=

atoms_y:
sHU5AEjAHwBoTScAaE0nAGhNJwD4Yg4A+GIOAPhiDgDAQQMAqCYTAOAnGwB4jisA8AkzAACkOABgSjwA4N4EAHBxCgAAtBQAIOclAICbFgBgeRcAkOkcABC5IgDAES4AkHsNAOABLQBw0jAAcK8IAMAOOwA=

atoms_z:
yE40AAiCKgCITTkAiE05AIhNOQBYvDEAWLwxAFi8MQCQPSgAYBgjAHA8MACgJioAYIc2AADPHADgZxwA4MoxAAB5IgAA/y0AAMUmAEA1JgCwYjMAwHI7ALByKACAdzUAsMEfAJDOLQCQnzkAgOg3ABBSLwA=

atoms_occupancy:
AAk9AAAJPQAgCyAAgN4PAGAfDQCgVDMAoN8HAMDUAQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
gO0AAAC+AAB4lgAAeJYAAHiWAAAoggAAKIIAACiCAABIngAAkIgAALB8AACYigAAaJwAALgDAwBI/QAA+MUAAAjAAAA4rgAAGLoAACi0AAAQuAAAGLAAAFCgAAAYugAA2McAAAi2AACo2QAAeOsAAMjXAAA=

qdat:
AAAAAAAAAIAAAAASABCAEAIBAAgBgAQMoADFIRCKAggASYEWWCyCkClhoaRWEFBy/YsmGGF3ToYOWbnMhP6Os+7BW9V7Lu/d9/Jbv2sf3p/G7f//5e/f739+b8vu6/9Pffvt/trbvV+3f+2/f/7//Xe++fv//f+/975ev5==


formula: Ca2 Fe1.703 Mn.06 Mg.187 Al.05 Si5 H O15
compound: Westfield, Massachusetts, USA
pub_title: Cation distribution in Mg, Mn-bearing babingtonite from Arvigo, Val Calanca, Grisons, Switzerland
formula_title: <missing>
a: 7.458
b: 12.168
c: 6.675
alpha: 86.12
beta: 93.86
gamma: 112.27
cell_volume: 558.711
crystal_density: 3.364
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:
["Cal", "Ca2", "Fe1", "Mn1", "Mg1", "Fe2", "Mg2", "Al2", "Si1", "Si2", "Si3", "Si4", "Si5", "H1", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15"]

atoms_x:
WNoJAGhAEQBoDQMAaA0DAGgNAwDYewsA2HsLANh7CwAAri4AAA00APABJwAgWSwAcAwfAOACMQBAKzAA4P45AMD+LAAgSAEAIE8EAFBEKgDQUhkAoLEwAEBIJwCA9DUAIB8MACCIIABwkhEA8IwUAGDmIgA=

atoms_y:
8Hs5AEDDHwBoSCcAaEgnAGhIJwD4XQ4A+F0OAPhdDgAQPQMA2B4TAOgpGwCwiCsAUPoyAAAnOAAAQTwAsOYEAMBsCgBgpBQAUN8lAPCZFgDQdxcAcP8cANCyIgDAES4AsH4NABD6LADwrDAAsLUIAKALOwA=

atoms_z:
sE00AJB8KgCoVTkAqFU5AKhVOQAI0DEACNAxAAjQMQBAQigA0BYjAAA+MAAAFyoAUJI2AGC5HQDwdRwA8NgxALBkIgCACy4AwL4mAHBGJgBwdTMAYGk7ALBZKADQcjUAYN8fANC7LQCAqjkAEAM4AHBbLwA=

atoms_occupancy:
AAk9AAAJPQBAfC8AgKkDAEDjCQAgdTgAoIYBAEANAwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
aLUAABicAAD4dQAA+HUAAPh1AADwZAAA8GQAAPBkAADIeAAAyG4AAPBkAADobAAA2HIAAKi0AgC40wAAaJIAACi0AACYigAAOKQAAIiQAABwlAAAWJgAAJCIAACAjgAAOKQAAIiQAAAYsAAAWKIAACi0AAA=

qdat:
AAAAAAAAAIAAAAASAAiACAIBAAgAwAIEUABlERCGAQQAKUEXNBpBSCVp0JJVCBB0vUcqBCjWp0MLGG/thF/P+ebhWNbYnWNsP74v39lvN/eW9r/b8fOn//92lfK9Lf9nX3/Ufu1/z3O/X/t79f///Xr//783///37+/b2/==


formula: Ca2 Fe2 Si5 O15 H
compound: <missing>
pub_title: Structure of babingtonite
formula_title: <missing>
a: 12.18
b: 6.68
c: 7.50
alpha: 93.98
beta: 112.32
gamma: 86.05
cell_volume: 562.539
crystal_density: 3.384
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:
["Ca1", "Ca1*", "Ca2", "Ca2*", "Fe1", "Fel*", "Fe2", "Fe2*", "Si1", "Si1*", "Si2", "Si2*", "Si3", "Si3*", "Si4", "Si4*", "Si5", "Si5*", "O1", "O1*", "O2", "O2*", "O3", "O3*", "O4", "O4*", "O5", "O5*", "O-H6", "O-H6'", "O7", "O7*", "O8", "O8*", "O9", "O9*", "O10", "O10*", "O11", "O11*", "O12", "O12*", "O13", "O13*", "O14", "O14*", "O15", "O15*"]

atoms_x:

atoms_y:

atoms_z:

atoms_u_iso:

qdat:
AAAAAAAAAIAAAAASABCAEAIBAAgBgAQMoADFIRCGAggASYEWaExCkClxYaSWEFByfYsmCGF/RYYOWXrchP+f80bBe/OrOu/899Jbv2sO3p9OZXb75etP91/+L+vea/9n//v93777v2d3f+2//36/9b+/+/v61f//7/7fv5==


formula: Ca2 Fe2 Si5 O15 H
compound: <missing>
pub_title: Structure of babingtonite
formula_title: <missing>
a: 12.234
b: 6.707
c: 7.682
alpha: 93.97
beta: 111.53
gamma: 85.25
cell_volume: 583.826
crystal_density: 3.261
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:
["Ca1", "Ca2", "Fe1", "Fe2", "Si1", "Si2", "Si3", "Si4", "Si5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "H"]

atoms_x:
8I4DABBBHQCgvRUAUKkuADAcEwBAPwMAsP4yAMCHKwCQJxsAYJgWAEArFwAgnhQAcHEKAJDjBABwPzwAYPUsAFBTNADgtzAAUIovACAbLgCwryIAAAEdAFCEFwCACDsA4GE2AA==

atoms_y:
YLoIAFCJEgCgrAMAcDkLAKAeIwAgPygAwJA2AFASKgCQPzAAsEwmAFBYFgAQDS4AsGQiAGC+MQBwaRwAkLUtANACBQDAlzkAoEIdAABrNQDwXygAYGk7AOBzMwBAYy8AYEIcAA==

atoms_z:
sLgUAMBBDQAAcRsAUAYTAECCFQCQNxAAkH4AABDTDQCAcggA8KkLADA9GgDwxx8AYJYOAFCFGwAQohEA8DwAACDgCQDwLzAAEGoSAFBrFwDQuAgAUCUSAPD/NwCgQgQAIOgQAA==

atoms_u_iso:
KKoAADCsAABYmAAAkIgAAOhsAAC4dAAAoIIAAMhuAADwZAAASKgAAHiMAACIkAAAWKIAAGicAAAYsAAAILIAAHiWAAA4rgAAiIYAAKh6AADIbgAAaJIAAECmAABYogAA+IwCAA==

qdat:
AAAAAAAAAQAAAACCACEAgAgEAIAKAIAoQBAaBUEREQAhoAVpQFBwAcxouA2BCJ7tMlQm6GpXSLM3W24VstUmfxpf/touX7z9Wl3Pj//IPE/Z7Pef33vX/v3x//PHJ/3n9/vv3/+/6/8uvd2X+++dfb/uX7v/fmv7/7//n7==


formula: Cl.55 S.04 C.409 Fe.012 Sr.016 Ca1.352 Na2.188 K.16 Si8 Al4 O25.388
compound: Lake Clear, Ontario, Canada
formula_title: <missing>
a: 12.07899
b: 12.07899
c: 7.583467
alpha: 90
beta: 90
gamma: 90
cell_volume: 1106.443
crystal_density: 2.633
atoms_x: wMYtAMDGLQDAxi0A8HslAPB7JQDweyUA8HslAPB7JQAYACQAUIw3ABByKABQPisAUJk5AFCzJAAQfjAAIMAfANAdJgBAljMA
atoms_y: wMYtAMDGLQDAxi0A6KsgAOirIADoqyAA6KsgAOirIADIQSgAMCAKAPA3BQBQmiQAsKIHAFCaCwBQCQYA4K4lAIC3OwDghTAA
atoms_z: wMYtAMDGLQDAxi0AAJUuAACVLgAAlS4AAJUuAACVLgDQKg8A4AMDAACxOgBAWw8AkB4QAHChAgCg8joAkMoEANBsBAAg1zAA
atoms_occupancy: wJEhAABxAgCg9hgA4C4AAIA+AABAoRQA4GIhAABxAgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQDgLRUA
atoms_u_iso: MHwDADB8AwAwfAMAEDoBABA6AQAQOgEAEDoBABA6AQBQeAAAEIsAABCLAAAgFgEAIBYBAFBZAQBgHAEAkEYBAKBtAQAwfAMA
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:
 Complete Al-Si order in scapolite Me37.5, ideally Ca3Na5[Al8Si16O48]Cl(CO3),
 and implications for antiphase domain boundaries (APBs)

atoms_sites:
["ClA", "SA", "CA", "FeM", "SrM", "CaM", "NaM", "KM", "Si1", "Al2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "O7C"]

qdat:
AAAAAAAAAAAAIAAAIIAAAAABEAAKAEQACASABgJAAAIAYGgCCgEBwAHQMTBBkKcACQosIqBWAFDNCHEcAUd6DBvQaJ6mjdBwupVcQ1nhRqiokFd1NXYVOkgohVSJzXKgaoWGGKGkhR+VZEssCgGlVCBlARGGXEJACAKokg==


formula: Cu Se O5 H4
compound: Gansu Province, China
formula_title: <missing>
a: 8.177
b: 8.611
c: 6.290
alpha: 90
beta: 97.27
gamma: 90
cell_volume: 439.332
crystal_density: 3.425
atoms_sites: ["Cu", "Se", "O1", "O2", "O3", "Wat4", "Wat5"]
atoms_x: 8CQdAOBDCQCQFw0AoJMcAIAlAAAQlAsAAEUaAA==
atoms_y: 0BkWAOAiNABwmCkAEFkZAKDEMQBw8hoAMJAIAA==
atoms_z: UMIVAMCxJABAIykA8NwoANCqGwDQ4RYAEL0ZAA==
atoms_occupancy: 0
atoms_u_iso: 0
atoms_aniso_label: ["Cu", "Se", "O1", "O2", "O3", "Wat4", "Wat5"]
atoms_aniso_u11: aJsBAAD6AAAIKAIAyAgCAOCfAgDIDgEAyIUCAA==
atoms_aniso_u22: MFIAABiwAADAZAMAQNMAAMDBAACQiwIAQFoBAA==
atoms_aniso_u33: 4N0AALAhAQBwGwEAaKYAAPjNAgCAe///gHcDAA==
atoms_aniso_u12: ILj//8g8AADQvwEAMFEBAFB2AgBQj/3/6GEBAA==
atoms_aniso_u13: GBAAAMhb//8Qp/3/QO/9/8hH///gNv3/aMEDAA==
atoms_aniso_u23: kL39/8B4/v9wlv7/4Lv6/2B0+f9ICgMAUOIEAA==
pub_title:
 The crystal structure of clinochalcomenite
 Note: reported coordinates do not produce the reported bond lengths

qdat:
AAAAAAAAAAAABAAAACAACAAAIFAEEEAAAUCGAECISEBADDEADEInI0JigbFUCIQQVmwwYngkpgbzNNJhZ23oT6RMy/e2SnjlVvffL1i/2L3WO9S/N4/y3u7/0//z+t97v/+/bf/9PX637/7e+n+v/9v1f//v7/r+vz1/f3==


formula: Na.4 Y.26 Ce.2 La.1 Nd.05 Dy.03 Gd.02 Pr.01 Er.01 Yb.01 Sr.73 Ca.15 Ba.03 C2 O7 H2
compound: Khibiny alkaline massif
pub_title: Polymorphism of donnayite (Na,TR)Sr(CO3)2*H2O
formula_title: <missing>
a: 8.983
b: 8.985
c: 6.780
alpha: 116.25
beta: 102.76
gamma: 60.00
cell_volume: 425.041
crystal_density: 3.591
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:
["NaA1", "NaA2", "NaA3", "YA1", "YA2", "YA3", "CeA1", "CeA2", "CeA3", "LaA1", "LaA2", "LaA3", "NdA1", "NdA2", "NdA3", "DyA1", "DyA2", "DyA3", "GdA1", "GdA2", "GdA3", "PrA1", "PrA2", "PrA3", "ErA1", "ErA2", "ErA3", "YbA1", "YbA2", "YbA3", "Sr1", "Sr2", "Sr3", "Ca1", "Ca2", "Ca3", "Na1", "Na2", "Na3", "Ba1", "Ba2", "Ba3", "C1", "C2", "C3", "C4", "C5", "C6", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "Wat19", "Wat20", "Wat21"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAAAAAAAAAAAECAAQAAABAAgAigAIAAiAEAgkAMIAIDACEAhEAGg7BAEAUlAUhhAPAcjERA0SnTBE+RJFGCRgQ1tgU0pQbRpi1UodM5xaVuQ9rl2tSXe53v1bK91Py7Vnu3uwf6u7st/loGU+ZZW2t3gp3idtkz4v8rvZ==


formula: Na.5 Y.24 Ce.11 La.09 Gd.02 Dy.02 Er.01 Yb.01 Pr.01 Sr.71 Ca.19 Ba.09 C2 O7 H2
compound: Khibiny alkaline massif
pub_title: Polymorphism of donnayite (Na,TR)Sr(CO3)2*H2O
formula_title: <missing>
a: 5.211
b: 5.211
c: 18.357
alpha: 90
beta: 90
gamma: 120
cell_volume: 431.692
crystal_density: 3.372
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", "Y", "Ce", "La", "Gd", "Dy", "Er", "Yb", "Pr", "Sr", "Ca", "Ba", "Na", "C", "O1", "Wat2", "O2", "C2", "O3", "O4"]

atoms_x:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACgRff/oFAKAKBQCgCgUAoAAOIEAOCNBQA=

atoms_y:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABguggA4HsIAOB7CADgewgAoAgWAMAzBwA=

atoms_z:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQHYwAEB2MABAdjAAQHYwAABkGQDAwRkAQMoiAEDKIgBAyiIAYJo3ACDbJwA=

atoms_occupancy:
QOgdAACmDgDAtgYAQH4FAIA4AQCAOAEAQJwAAECcAABAnAAAwFUrAMCYCwBAfgUAQJwAAAAJPQAACT0AOCwKAAgWBQA4LAoAQEIPADgsCgA=

atoms_u_iso:
AHIBAAByAQAAcgEAAHIBAAByAQAAcgEAAHIBAAByAQAAcgEACMAAAAjAAAAIwAAACMAAABgPAQBoUAEAMNwCADDcAgAw3AIAIFQEAEieAAA=

qdat:
AAAAAAAAAAAAAAAAAQAAAAABABAAAAAAEAQABAAAQAACAASBAAAaBAEAAAAAASEAAUACACACAUAAECAAIAQBEAGIIAAACkAMAgAAA5AGAgICCgAiAAAASAQEEBDIDIgAAaAwIAAIAgAQQKAoggiAMgAASBBAAIBABCFAog==


formula: Na1.5 Li Ti2 Si4 O16 H5.5
compound: the Lovozero alkaline massif, Kola Peninsula, Russia
formula_title: <missing>
a: 27.483
b: 8.669
c: 5.246
alpha: 90
beta: 90.782
gamma: 90
cell_volume: 1249.744
crystal_density: 2.716
atoms_sites: ["Na", "Li", "Ti", "Si1", "Si2", "O1", "O2", "O3", "O4", "O5", "O6", "O-H7", "O7", "Wat8"]
atoms_x: 8BkKAAAAAAAQBAoAsDoQAOCNBQBgogwAEIkRABBnBgCwHwgAEIkRALBwBwAQAgIAEAICAIC0/f8=
atoms_y: QAkMADBuFgAQwxgAEP4jAOAKBgBQPCMAIGYuAKBUAQBAfRoAgAceACBYDwDg/gcA4P4HAOCFFwA=
atoms_z: MNPo/0BCDwCAqgcA0LQRALDfAQCgoxEA8EAQAOBxEgAw2RkAoP0CAFB+///g3QAA4N0AAGAC/f8=
atoms_occupancy: wMYtAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQDAxi0AQEIPAAAJPQA=
atoms_u_iso: wIkBAKCMAADA2gAAwMEAALCUAQBA5wAAoAkBAADuAgDQAQEAQOcAACBIAQCggAIAoIACAADKCAA=
atoms_aniso_label: ["Na", "Li", "Ti", "Si1", "Si2", "O1", "O2", "O3", "O4", "O5", "O6", "O-H7", "O7", "Wat8"]
atoms_aniso_u11: QBMCAEAfAACQFAEAwAwBAKBtAQCAOAEAAHcBAIAyAgDgKAEAAPoAAMDUAQCAtQEAgLUBAEB4BgA=
atoms_aniso_u22: wD4BAGBtAACQyQAAILIAANAzAQBg6gAAwNoAAICvAgCAOAEA4CgBAOAoAQBgWwMAYFsDAKBoBgA=
atoms_aniso_u33: sEkBAOAoAQCQsAAA8IcAADAeAgAAlgAAIMsAAKD3AwBAnAAAAJYAAGDqAACggAIAoIACAMCMDQA=
atoms_aniso_u12: YDsAAAAAAAAgAwAAkAEAAEDt//+w6///sNL//6APAACg3f//QO3//xCq//8gywAAIMsAACBa/v8=
atoms_aniso_u13: 4GAAACBOAABw/v//UPv//6D2///A+f//EMP//6CS//+AJQAA0AcAAIAMAAAAAAAAAAAAAKBoBgA=
atoms_aniso_u23: AM7//wAAAADwCgAAcP7//2AJAAAgAwAA0O7//0ATAgBQ4v//UMn//0Dt//9AnAAAQJwAAOBA/f8=
pub_title:
 Eliseevite, Na1.5Li[Ti2Si4O12.5(OH)1.5]*2H2O, a new microporous titanosilicate
 from the Lovozero alkaline massif (Kola Peninsula, Russia)
 Note y-coordinate for O3 changed from .218 to reproduce reported bond lengths

qdat:
AAAAAAACAAAACAAQCAAAAAFCQIQAEIMIIIAiMAxghmgpAyaIItGAZFcUgYAAOMKafQkgCk0iNKQ6hoOBM3C5a5rra4gowOuMKpG5LZSrtHa1Rpvd4HjJZvkj12/O2Lfec8YsEiR/JRI05h1StnCbxppJJTRhHWKpqDdp7R==


formula: Ca6.66 Al7 O16 Cl1.11
compound: Northwest Africa 1934 CV3 carbonaceous chondrite
pub_title: Brearleyite, Ca12Al14O32Cl2, a new alteration mineral from the NWA 1934 meteorite
formula_title: <missing>
a: 11.98
b: 11.98
c: 11.98
alpha: 90
beta: 90
gamma: 90
cell_volume: 1719.374
crystal_density: 2.902
atoms_sites: ["Ca1", "Ca2", "Al1", "Al2", "O1", "O2", "Cl"]
atoms_x: YIklAODfIQAgywAA4Gc1AABXMABAYAoAYOMWAA==
atoms_y: AAAAAAAAAAAgywAAAAAAAGDMBQBAYAoAAAAAAA==
atoms_z: QEIPAEBCDwAgywAAQEIPAIBPEgBAYAoAQEIPAA==
atoms_occupancy: QP8uAIDAFAAACT0AAAk9AAAJPQAACT0AQJUWAA==
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAEAACAAAAAAACAAgAAAQAgBAEAABAEAAABAICAAIEBAgQIAABAgggQQQAQQAQgggBCEEIQgCAIQhEARAAQiARCAiEBABCIgIAJAAESAiAEAAEAAAEAAAAAAAAEgAAAAAAAAAAAAAAAAAAAAAAA==


formula: Na3 Fe P C O7
compound: <missing>
formula_title: <missing>
a: 8.955
b: 5.149
c: 6.629
alpha: 90
beta: 90
gamma: 90.45
cell_volume: 305.649
crystal_density: 3.040
atoms_sites: ["Na1", "Na2", "Fe", "P", "C", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_x: EBIQABADOABwWScAsMIjAABTOQDQWTUAwFE0AIDuBADQiCkA8IEaAGDLGgA=
atoms_y: kD0PAKBRDgAQiA0A8BsSAIB0EADg6gIAkAIdACBlEQCQew0A4PIJAJDPGAA=
atoms_z: ADIAAMDGLQBAQg8AwMYtAEBCDwBAQg8AQEIPAEBCDwDgXCIAwMYtAEBCDwA=
atoms_occupancy: 0
atoms_u_iso: YPkAAHBIAQBIngAA6GwAAHCUAADA1QAAeOsAABAXAQC40wAAGLAAAPi7AAA=
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 chemical characteristics of bradleyite, sidorenkite and bonshtedtite
 Note: atomic parameters from ICSD

qdat:
AAAAAAAAAAACAAAAAAACAAAMACAAYAASACBQAAEICAICIQBwBKAUBkgAWAEgUA0y4EHMADWFqQBYQ4zBBNNpHisZXCUjgs7nDyVLGhO7HPk7ExIZf6pXmv3B4z/y887x/Mw3r6HDqfycVb6zfc/9omvw2leyc+2T4nP9vf==


formula: Cu5 Cl2 O10 H12
compound: New Cliffe Hill Quarry, Stanton-under-Bardon, Leicestershire, UK
formula_title: <missing>
a: 10.3113
b: 6.7606
c: 8.8386
alpha: 90
beta: 111.468
gamma: 90
cell_volume: 573.397
crystal_density: 3.248
atoms_sites: ["Cu1", "Cu2", "Cu3", "Cl", "O1", "O2", "O3", "Wat4", "H1", "H2", "H3"]
atoms_x: gIQeANCBHABAQg8AMDMLANBGGwDQPRAAgIQeADDJCwAAQB8AwIAPACCsGgA=
atoms_y: gIQeAICEHgBAQg8AgIQeAADyEgCAhB4A8BUTAICEHgBgJQwAgIQeAGAlDAA=
atoms_z: AAAAAFjBEwAAAAAAkP4MAADjCACAs/n/gIQeANCZIgBAYAoAIKLy/8CvHAA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AICEHgA=
atoms_u_iso: QJwAAPDSAABAtQAAsP4AADDZAAAgFgEAAF4BAOCGAgDA1AEAwNQBAMDUAQA=
atoms_aniso_label: ["Cu1", "Cu2", "Cu3", "Cl", "O1", "O2", "O3", "Wat4"]
atoms_aniso_u11: gKIAAHARAQDQzwAAoNcAACDkAACwEQIAEBsCAFDjAwA=
atoms_aniso_u22: YJ8AAHDGAABQkQAAUA4BAMDBAADAqAAAUA4BANB4AgA=
atoms_aniso_u33: kLAAAJCXAAAQvQAAACwBAHDfAABAgwAA8NIAAJAtAQA=
atoms_aniso_u12: AAAAAAAAAACw6///AAAAAJAzAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: UF8AADBDAADARAAA4HkAAJBMAAAQcgAAIGcAAHDfAAA=
atoms_aniso_u23: AAAAAAAAAABgCQAAAAAAAEDt//8AAAAAAAAAAAAAAAA=
pub_title:
 Description and crystal structure of bobkingite, (Cu2+)5Cl2(OH)8(H2O)2,
 a new mineral from New Cliffe Hill Quarry, Stanton-under-Bardon, Leicestershire, UK

qdat:
AAAAAAAAAAAACAAAAAAgABAAAkAAAgAgAEBAQBQQQAUCAAgCATHAAEAAjAiSDAoWAHAiEDRSHIFBYC9FSAGs5ABpFYQJalakNZZ9tJCZeOnuP8wXXOOpj5H05OgN3lG+16o9TTuL7RL/x0t8Hv6M7zwdniF/8vPv4+z805==


formula: Zn S O10 H12
compound: synthetic, made by dehydration of ZnSO4*7H2O
formula_title: <missing>
a: 9.981
b: 7.250
c: 24.280
alpha: 90
beta: 98.45
gamma: 90
cell_volume: 1737.883
crystal_density: 2.060
atoms_sites: ["Zn1", "Zn2", "S", "O1", "O2", "O3", "O4", "Wat5", "Wat6", "Wat7", "Wat8", "Wat9", "Wat10"]
atoms_x: AAAAAAAAAACA+jQAQHwvAIDQOwDABzgAYMQwAAAiJABgpyAAoJ0SACAENgDAEzYAQF40AA==
atoms_y: AAAAACDsOQCAlhsAoK4kAMA4GwCABx4AgNgQAOAgLAAg1hMAIP8hAGC0CQCAKi0AIOw5AA==
atoms_z: AAAAAEBCDwDAlwcAgEAIAHBYCgCgQgQAEEgHANDcAgCQGwQAgFEBAPA6EQAASREAMM8KAA==
atoms_occupancy: 0
atoms_u_iso: +IwCAMBRAgBQswEAiAICALgDAwC4AwMA6D0CABAqAgBIeQIA+IwCACjHAQBgFgIA+IwCAA==
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:
 Zur thermischen Dehydratisierung des ZnSO4*7H2O und zum
 Hochtemperaturverhalten von wasserfreiem ZnSO4

qdat:
AAAAAAAACAAAAAAAAEhACQAgQAwABYQCAhBh2SAwCwoGGpYgWoIY8xN55D9asFjORcMEcZia7y7Kq5tLqHeWHNvfaf/vNnpcd8a4PTyubu9O+9quPif3PG1W/v09Z9f48StzfvbMK0pk5z86u83LtbXSxpBgxd21GOVClK==


formula: V3 Na.5 Ca.25 O9 H2
compound: Paradox Valley, Montrose County, Coldrado,USA
formula_title: <missing>
a: 12.26
b: 3.58
c: 8.11
alpha: 90
beta: 92.5
gamma: 90
cell_volume: 355.616
crystal_density: 2.992
atoms_sites: ["V1", "V2", "V3", "Na", "Ca", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "Wat"]
atoms_x: 4BYEAMArMgCA9SAAYH4SAGB+EgDgWzcAgIsIAOD9HACAWToAwA8NAECgKQDguycAgJwaAIA2KwA=
atoms_y: QEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwA=
atoms_z: QGAKAGDABwDAqDIAANsaAADbGgAgCjUAgHE2AOAEBwBANhEAII8KACC/AgAgQCwAwOQoAAD5FQA=
atoms_occupancy: AAk9AAAJPQAACT0AgIQeAEBCDwAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: wFECAMBRAgDAUQIAwFECAMBRAgDAUQIAwFECAMBRAgDAUQIAwFECAMBRAgDAUQIAwFECAMBRAgA=
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 crystal structure of a sodium-calcium variety of metahewettite
 Sample: hydrated
 Note: sample is half-way between barnesite and metahewittite

qdat:
AAAAAAAAEAAAAgABAQAAABAAADAEAQECgJQAEwBgwICiAwAcECBLjFASAAG5qhERiPWFMKVhOi8Ioltx5AbjQcw/6Y8vtIX52b63lPOORPyOYvqfOS9pK/Zp3/HW332Tq/V2tyf2+9PI7x0ux/X7F+rOOZFmzHm5fmZ4k1==


formula: Mn2 As O5 H
compound: Langban, Filipstad, Varmland, Sweden
pub_title: Redetermination of eveite, Mn2AsO4(OH), based on single-crystal X-ray diffraction data
formula_title: <missing>
a: 8.5478
b: 8.7207
c: 6.2961
alpha: 90
beta: 90
gamma: 90
cell_volume: 469.329
crystal_density: 3.762
atoms_sites: ["Mn1", "Mn2", "As1", "O1", "O2", "O3", "O4", "H1"]
atoms_x: AAAAANjfFQBY2g4AIKUXAABLGQAQTgYAUJ0NAGCEEQA=
atoms_y: AAAAAJgoCAB4qg8A4L0WABCjFQAg8BcAUMAIAEAMGAA=
atoms_z: WBYPAICEHgAAAAAAgIQeAAAAAAAAAAAAsDMNAICEHgA=
atoms_occupancy: 0
atoms_u_iso: YKQAABCpAADYcgAA0J0AALCzAAAwCwEAsMwAAECQAgA=
atoms_aniso_label: ["Mn1", "Mn2", "As1", "O1", "O2", "O3", "O4"]
atoms_aniso_u11: mMYAAICnAACIcgAAEKQAAJCXAACwmgAAUNwAAA==
atoms_aniso_u22: kKYAANiQAACIXgAAcHsAAFDcAABAgwAAcN8AAA==
atoms_aniso_u33: 0H8AANjCAACghwAA8LkAAKClAAAwBQIAwKgAAA==
atoms_aniso_u12: EB0AADgEAACo7v//wPn//4Co//9wFwAAcLP//w==
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAENz//w==
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAoCgAAA==
qdat:
AAAAAAAAAAAAAAAAAQAAGAABkAAoAAACgIIAAEyCIsRlAAChgkEsJRlgLgESFMv9FBUhCqLzp2lgats/LFmk7irde7221/ml5L/X/y/t3Oxx1/73/e5b33Xv3//f/f/vvf7///Vf89//7p+b6v//0+/P//0r/DvbbvZ+/Z==


formula: Mn8 Si6 O25 H10
compound: Kyurazawa mine, Tochigi Prefecture, Japan
pub_title: The crystal structure and polytypism of manganpyrosmalite
formula_title: <missing>
a: 13.42
b: 13.42
c: 7.159
alpha: 90
beta: 90
gamma: 120
cell_volume: 1116.575
crystal_density: 3.028
atoms_sites: ["Mn1", "Mn2", "Mn3", "Mn4", "Si", "O1", "O2", "O3", "O4", "O-H1", "O-H2", "O-H3", "O-H4"]
atoms_x: AAAAAJChDwCAhB4AwDkfACDeGgDgGhQAYJsiAPA2GgCwChgA4AULACA0FQBgmyIAq7AoAA==
atoms_y: AAAAAAAAAAAAAAAA4JwPAMCdBgAAAAAAwC0IALAaDQDgkwQA8IIFABCaCgDALQgAVVgUAA==
atoms_z: AAAAAAAAAAAAAAAAgEsCANDrJQCAhB4AcMghAABBIwDgpTMA0DIvAFCGBgBgjwsAkBMvAA==
atoms_occupancy: 0
atoms_u_iso: uK4CAMCJAQDQ7AEAmJ0BAAi2AAAIdAEAqCUAAJDdAABY9wAAeIwAANCDAQCIwAIAsGoDAA==
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:
AAAAAAAAAgAAAACCAQgAAIARAAAggQCQEQMCgCBJAIhDBgFOAhyEQDjQrA1wNUVYXgqgimcPg3h8ZpsPw8M5oNxfSXxvdWz42tW/4dLt1z9+mWbvF2nh7/393dHE575of/i3vrZMmd73/NOeL37e+TzU/r2m1Tq2ovdhAf==


formula: Mn8 Si6 O24 Cl H9
compound: Central Kazakhstan
pub_title: The crystal structure of pyrosmalite
formula_title: <missing>
a: 13.37
b: 13.37
c: 7.11
alpha: 90
beta: 90
gamma: 120
cell_volume: 1100.685
crystal_density: 3.127
atoms_sites: ["Mn1", "Mn2", "Mn3", "Mn4", "Si", "O1", "O2", "O3", "O4", "O-H1", "O-H2", "O-H3", "Cl"]
atoms_x: AAAAAEBCDwBAQg8AgIQeAKDrBQDgEAUAQJsVAACyDABgThoA4BAFAKDXMgBglSMAVVgUAA==
atoms_y: AAAAAAAAAADAxi0AAAAAAMA+GgCgcxkAAAAAAABXMACguiIAIPg3AGAxCgCgcxkAq7AoAA==
atoms_z: AAAAAAAAAAAAAAAAAAAAAKD8FwDgdQkAgIQeAKBhHACgYRwA4HUJAOB1CQDgdQkAwCcJAA==
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
qdat:
AAAAAAAAAgAAAACCAIgAAEAIgAAQQEBICIGBQAgkgEQgwQDlAYpBEA5kUwI6EzKeNwToIRnH4L4NGefC+KjOdC+dtxcXnr+eHztq2Dz/fpXP6zr78/ysHPd/X5sWXv/+TtqNdf7sW4v/f90c4+Xf/aNnW7tqLezZ4w9NjA==


formula: Li Ca2 Mn2 Si5 O15 H
compound: Foote mine, Kings Mountain, North Carolina, USA
pub_title: Lithiomarsturite, LiCa2Mn2Si5O14(OH) Note: rruff.info/R100094
formula_title: <missing>
a: 7.6467
b: 11.7315
c: 6.8100
alpha: 91.874
beta: 94.465
gamma: 105.933
cell_volume: 584.722
crystal_density: 3.285
atoms_occupancy: 0
atoms_sites:
["Li1", "Ca1", "Ca2", "Mn1", "Mn2", "Si1", "Si2", "Si3", "Si4", "Si5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "H1"]

atoms_x:
oBkoAOgxMQAoRw4AED8kAJCuAgAQLxEAeE0cAHhHMQAQ4DwAmLwUAPCjDABwgwcAcNkaANDaEwCgKiEAcJgpAJCyOgCQUCkAIKc4AGB0NQCA4zwAkLMMAIDJHwDAPS8A4DQYAEBAOQA=

atoms_y:
wMkHACB0OQC48B8A8H4nAIhzDgC4OgMAqIoTAJh0GwAg1ysAYIozAECJ///gLwQAwLwKAGgtFQCwGiYAYO0WAADUFwB47RwA6CsjANhELgDA4gwAkD0tADBnMQBwBQgAyDM7ACAkBwA=

atoms_z:
oF8UAMCCCAAogBEAoLsDAEAUCwAAJxUAaNgZANAiDQCAXhIAcJ0GAHAyIQDQjQsAAEsZAPBfDwDwHBYA4CEXAADdCQBQIQIAUJYUAJDRBwAQ8B0AQHoOAAAaBADgWwUAYBMPAABMHQA=

atoms_u_iso:
4BYEAKCgAADwwwAAqHAAANBwAABAgwAAAG4AAPhhAAAgdgAAcHYAADDyAABAtQAAgKIAAMCoAACQsAAAMKcAAEC1AAAgmQAA8KAAAGC4AACgCQEAUKoAAHDGAAAQvQAA8NIAAABxAgA=

atoms_aniso_label:
["Li1", "Ca1", "Ca2", "Mn1", "Mn2", "Si1", "Si2", "Si3", "Si4", "Si5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15"]

atoms_aniso_u11:
gKkDAADIAABwlAAAMGsAAIhoAABghgAAkGUAAMBdAADAdgAA8G4AAEAAAQAwpwAAcK0AAACWAAAArwAA0IQAAECcAADQhAAAMMAAADCnAABQpAEA4HkAAFCqAACg1wAAAMgAAA==

atoms_aniso_u22:
wLAHAPBuAAAAyAAAeGkAABBZAAAgZwAAwF0AAGBUAACgWgAAgHAAADDyAADwuQAAMFwAAGCfAADAqAAA8LkAAPCgAAAgsgAAQFEAACCyAADgkgAAYLgAAHDGAAAQvQAAsJoAAA==

atoms_aniso_u33:
wM4CAECcAAAw2QAAMHoAAKCMAADAjwAA4HkAAGBtAACAiQAA0IQAAPCgAABguAAA8NIAAGC4AABQqgAAgKIAADDyAABQkQAAMMAAAODdAABguAAA4MQAAEAAAQBAnAAAMAsBAA==

atoms_aniso_u12:
4BYEABATAADYGAAAABkAAOgXAADAEgAAYAkAADARAADAEgAA0CAAAMDH///gLgAAQB8AABAnAAAgHAAAkAEAAMBEAACAJQAAoA8AADBDAACA8///oA8AANBSAAAAMgAAUC0AAA==

atoms_aniso_u13:
gDICAPgbAADQ/f//IA0AAAAAAADA+f//0AcAACADAADQBwAAEA4AALA2AAAQ9f//0O7//4Da///gFQAAkBoAAJAzAABQ+///EPX//7AEAADgeQAAsB0AAOBHAAAA5///YAkAAA==

atoms_aniso_u23:
4CICAFjz//+4yv//kPz//6D7//+g9v//AAAAAOD8///g/P//AAAAALAdAABw/v//0O7//5ABAABg1///wCsAAADn///gFQAA4Pz//9A5AAAAzv//QDgAACAcAABQLQAAwMf//w==

qdat:
AAAAAAAAAIAAAAIEAAGQAAgABCIBCABBHCCQAxQQAgNIgQNRIjRJJAA/K4SgWpLlbsoOSYeEMbOCFyrPOK0bhV3/XJ9uqzJ/HJ7O0X/93e1E697+re/9/9W7f/qu+r1+/p6/TX/s//e/f+1v7//bt3fNz78+/tH/br/Pt/==


formula: (Ti2.8 Nb1.2) Si8 (Zn.9 Fe.05 Mn.05) Na1.6 Ca Sr1.4 K.5 O32.87 H12.11 Ba.1
compound: Lovozero alkaline massif, Kola Peninsula, Russia
formula_title: <missing>
a: 14.491
b: 13.911
c: 7.822
alpha: 90
beta: 117.59
gamma: 90
cell_volume: 1397.487
crystal_density: 3.103
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:
 New Zn-rich representative of the labuntsovite group:
 crystal structure and microtwinning
 Note: x-coordinate of O15 was changed

atoms_sites:
["Ti(1)", "Nb(1)", "Ti(2)", "Nb(2)", "Si(1)", "Si(2)", "Si(3)", "Si(4)", "Zn", "Fe", "Mn", "Na", "Ca", "Sr", "Na", "K", "Wat", "H", "Wat", "H", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O-H(5)", "O(6)", "O-H(6)", "O(7)", "O(8)", "O(9)", "O(10)", "O(11)", "O(12)", "O(13)", "O(14)", "O(15)", "O(16)", "Wat(2)", "Wat(3)", "Wat(4)", "Ba(4)"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAAAAAAAAAQAAAwIAAAAMQAgCBAAAZACLQkgAEAMlCQNYCHggVUkKNHFGQEaetQjxmseM27sdivZiIYrdvrtu5FzF/zuSW2O4FTr7Nnk+jNNy/+0mx8vlUpXfpwd2RDC94SX659rxhxRL/ZMsdJuVf1BH8/3Kic+KXOkd==


formula: Mn3.81 Mg.35 Fe.33 Ca.51 Si5 O15
compound: the Morro da Mina mine, Conselheiro Lafaiete, Minas Gerais, Brazil
pub_title: Ca-Mg-Fe-rich rhodonite from the Morro da Mina mine, Conselheiro Lafaiete, Minas Gerais, Brazil
formula_title: <missing>
a: 6.6818
b: 7.6330
c: 11.795
alpha: 105.49
beta: 92.49
gamma: 94.01
cell_volume: 577.092
crystal_density: 3.666
atoms_sites:
["Mn1", "Mg1", "Fe1", "Mn2", "Mg2", "Fe2", "Mn3", "Mg3", "Fe3", "Mn4", "Mg4", "Fe4", "Mn5", "Ca1", "Fe5", "Mg5", "Si1", "Si2", "Si3", "Si4", "Si5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15"]

atoms_x:
mLAHAJiwBwCYsAcAICj+/yAo/v8gKP7/IHULACB1CwAgdQsAuHwMALh8DAC4fAwAUKkVAFCpFQBQqRUAUKkVAHjuEQDAJBYAaGEJAAjAHgDQBw8AMLUGAFDMCwDAagIA8HwGAJCFAwAQgB8AYMELAPD9FgBAUuv/8IcZAGBMEgCQsiEAkDcQAPCRDwDA8REA

atoms_y:
OFATADhQEwA4UBMAONg1ADjYNQA42DUAeCIfAHgiHwB4Ih8A6MkqAOjJKgDoySoAWFX9/1hV/f9YVf3/WFX9/8AUIQDQ5CwAaKcEAJiwLwCQoQ8AIFgPAHCdJACArwIAYHMYADCjCQAgXSMAUJ4bAACzKQBADjkAgOQOAECFCABQZC0A8N4wANCIKQAwyDkA

atoms_z:
oCYbAKAmGwCgJhsAmAE0AJgBNACYATQA4I4sAOCOLADgjiwAmH8BAJh/AQCYfwEAKGYSAChmEgAoZhIAKGYSACAHEACQYyAACO4nANBoNQDYmjcAuE8lAJhtIgDIlxMAwGsQAGCcOgBwly8A4BU3ALC1FwCoIzQA8N0YAEh5LwDASQAAsAY1AMBcCwAITiIA

atoms_occupancy:
ALY1AEANAwDARQQAQFI2AABxAgDARQQAwBk1AICpAwDARQQAwMYtAMAnCQCAGgYAgKIZAMAgHwCAOAEAQA0DAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
0GEAANBhAADQYQAAwF0AAMBdAADAXQAAkFsAAJBbAACQWwAA+HAAAPhwAAD4cAAAmKMAAJijAACYowAAmKMAAFBpAAAYZQAAMGEAAMBiAACAZgAAsIEAAGCGAACQfgAAIIAAACCAAABwewAA4JIAACCZAAAggAAA0OgAANCEAADAdgAAIIAAAEC1AADAwQAA

atoms_aniso_label:
["Mn1", "Mg1", "Fe1", "Mn2", "Mg2", "Fe2", "Mn3", "Mg3", "Fe3", "Mn4", "Mg4", "Fe4", "Mn5", "Ca1", "Fe5", "Mg5", "Si1", "Si2", "Si3", "Si4", "Si5", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15"]

atoms_aniso_u11:
MFwAADBcAAAwXAAAIE4AACBOAAAgTgAAYFQAAGBUAABgVAAAkH4AAJB+AACQfgAA0IQAANCEAADQhAAA0IQAAMBdAACgWgAAwF0AACBOAADgYAAAMI4AAMCPAACAcAAAYFQAAIBwAACwaAAAgKIAAOCrAACQfgAA8IcAABByAACQZQAAwF0AABCkAABw3wAA

atoms_aniso_u22:
8G4AAPBuAADwbgAA8GkAAPBpAADwaQAA4GAAAOBgAADgYAAAUJEAAFCRAABQkQAAEFkAABBZAAAQWQAAEFkAACCAAADQhAAAAGQAAMB2AABwewAAIIAAABCLAAAQiwAA4JIAAMCPAADwhwAAgIkAAGCfAACAiQAAwKIBAPCgAAAAlgAAQIMAAPDrAADgYAAA

atoms_aniso_u33:
8FUAAPBVAADwVQAAwF0AAMBdAADAXQAAkFYAAJBWAACQVgAAIE4AACBOAAAgTgAAgO0AAIDtAACA7QAAgO0AADBcAAAgTgAAUF8AADBcAAAQWQAAUHgAAAB9AAAwdQAA4JIAALCBAAAQcgAA4JIAACBnAABwewAAYLgAALBoAABAagAAgKIAAFCqAAAg/QAA

atoms_aniso_u12:
kAYAAJAGAACQBgAAGBAAABgQAAAYEAAAqAwAAKgMAACoDAAAIDoAACA6AAAgOgAA0PP//9Dz///Q8///0PP//4AMAAAgAwAAsAQAANAHAACQAQAAEA4AAHD+///w8f//8AoAAGAJAACQAQAA4BUAAODj//9ABgAA0AcAAHD+///A+f//4BUAAGAiAADgFQAA

atoms_aniso_u13:
8Pv///D7///w+///8Pv///D7///w+///GPL//xjy//8Y8v//6A0AAOgNAADoDQAAuDgAALg4AAC4OAAAuDgAAPAKAABQ+///cP7//+D8///A+f//UPv//6APAABABgAAYAkAAIAMAABwFwAAoPb//+AVAADQBwAAMPj//yDq//8Q9f//YAkAAPDx//8wdQAA

atoms_aniso_u23:
2BMAANgTAADYEwAAiBMAAIgTAACIEwAA8A8AAPAPAADwDwAA0CUAANAlAADQJQAA+PP///jz///48///+PP//5AaAACwHQAA4BUAAMASAADQIAAAECcAAOAuAAAAGQAAsB0AAKAoAAAgAwAAQDgAAAAAAADAKwAAQJwAABAOAADAKwAAMCoAAOBgAACgDwAA

qdat:
AAAAAAAAAQAAAAICAAFgAAQAAhQCEAAFKJECBUoQAgFoJARwCi0jEABMY0MCNBFryFOmxhushXcgkcX5uW3sB2/ZnmX7NT/2C/U34/f/f9cvM27f9b97+//uu2b+//9/99/+Fn76/76P9+3f9//Nvr+X+/du5+/3t75f/f==


formula: (Ba3.92 Sr.08) Ti2.96 Nb.02 Al.02 Na2.16 Mn.38 Fe.18 Mg.14 Ca.1 Si4 S1.02 P.82 O26
compound: Inagli massif, Yakutia, Russia
formula_title: <missing>
a: 5.4234
b: 7.131
c: 14.785
alpha: 98.442
beta: 94.579
gamma: 90.009
cell_volume: 563.757
crystal_density: 4.017
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:
 From structure topology to chemical composition. XI. Titanium silicates:
 crystal structures of innelite-1T and innelite-2M from the Inagli massif,
 Yakutia, Russia, and the crystal chemistry of innelite
 Note: this is the polytype innelite-1T

atoms_sites:
["BaAP", "SrAP", "BaBP", "SrBP", "TiMH", "NbMH", "AlMH", "TiMO1", "NaMO2", "NaMO3", "MnMO3", "FeMO3", "MgMO3", "CaMO3", "Si1", "Si2", "ST", "PT", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13"]

atoms_x:
8J4RAPCeEQCwOS8AsDkvABDaKQAQ2ikAENopAAAAAAAAAAAAwHEeAMBxHgDAcR4AwHEeAMBxHgCw0jEAUOIxAHAWLgBwFi4AwCUzAEBNIgDASwMAwDExAAAuIgBgWwMAYDUzAMBnKADAdBEAQC48AKDGIACgfiwAQP8uAA==

atoms_y:
SEkZAEhJGQBIrzUASK81AFCYAwBQmAMAUJgDAICEHgAAAAAAoC0tAKAtLQCgLS0AoC0tAKAtLQCgHw4AACMoANAxEgDQMRIAgI0QAPBdBwDAMwcAEFMaAGBALQCQHy0AQIcpAMBXAQBgPB0AIAYMAKDHCwCgLBAAoFUeAA==

atoms_z:
0KspANCrKQAQNCUAEDQlANA8DADQPAwA0DwMAAAAAAAAAAAAEP48ABD+PAAQ/jwAEP48ABD+PACQazEAwHwxAHDtHwBw7R8A0C44ABDVLgCgvS4AsOQuAKDvLgCg1i4AoDY4AEAzBQCAZTgAsM4hABC/IQDARBkAsK8iAA==

atoms_occupancy:
gNA7AIA4AQCA0DsAgDgBAIDQOwBAnAAAQJwAAAAJPQAACT0AgGYjAMCYCwBAfgUAwEUEAEANAwAACT0AAAk9AMAgHwBABhkAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_u_iso:
kEYBAJBGAQAAlgAAAJYAAFBGAABQRgAAUEYAAIBqAQBg6gAA8IEBAPCBAQDwgQEA8IEBAPCBAQCgDwAAwCsAAHARAQBwEQEAgD4AAGBtAADAXQAAIE4AAIA+AAAgTgAAQJwAAAD6AABAlgEAAHcBAGBnAQCArwIAYGECAA==

qdat:
AAAAAAAQAAAAAAJAAIAIAUQAEgCBCCYEAARjgECQnCYQOBUCDZuARUHJEEYYf8yaKT9gEuxJnXQ3A3t58TS/dqK3m7teL5jO5WV27uDPd494t9udv+dc386u+fvX6/zb8keZb3Zf+d69dcc/+e59PH5dn59/f39///tf4X==


formula: (Ba3.92 Sr.08) Ti2.96 Nb.02 Al.02 Na2.16 Ca.1 Mn.38 Fe.17 Mg.15 Si4 S1.02 P.8 O26
compound: Inagli massif, Yakutia, Russia
formula_title: <missing>
a: 5.4206
b: 7.125
c: 29.314
alpha: 90
beta: 94.698
gamma: 90
cell_volume: 1128.355
crystal_density: 4.012
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:
 From structure topology to chemical composition. XI. Titanium silicates:
 crystal structures of innelite-1T and innelite-2M from the Inagli massif,
 Yakutia, Russia, and the crystal chemistry of innelite
 Note: this is the polytype innelite-2M

atoms_sites:
["BaAP", "SrAP", "BaBP", "SrBP", "TiMH", "NbMH", "AlMH", "TiMO1", "NaMO2", "NaMO3", "CaMO3", "MnMO3", "NaMO4", "MnMO4", "FeMO4", "MgMO4", "Si1", "Si2", "ST", "PT", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13"]

atoms_x:
4AgwAOAIMAAAmhAAAJoQAACcMQAAnDEAAJwxAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAMBPEwCgMxMAUJsPAFCbDwDgFgQA4FwiAGDvFAAAjhIA4OUgAGDeAgDAYhQAIJMzACAoMABgihAAoIACAMCpHQDgkS4A

atoms_y:
kD8IAJA/CACYAygAmAMoAGB9JwBgfScAYH0nAPBqCQDQESgAgIQ3AICENwCAhDcAEBQYABAUGAAQFBgAEBQYAEAnOQBQcRYAMKoMADCqDADAJTMAMCQzAIDcOQCgPQkAsD0cAED0GwAAXRYAgNEmAABBCgCghgEA4DkTAEAqEwBAdjAA

atoms_z:
mIUFAJiFBQAIVAMACFQDAGggCQBoIAkAaCAJAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAKCICQAIbAkA4LAAAOCwAAAwRQgA0DsIAGDtDACgKggAgA4IAOAXCABwyQwAwKsMAIAJDQBgFgIAgJwBAECWAQAgdAIA

atoms_occupancy:
gNA7AIA4AQCA0DsAgDgBAIDQOwBAnAAAQJwAAAAJPQAACT0AQHAxAIAaBgDARQQAwFwVAMDrEgBAYAoAwCcJAAAJPQAACT0AwCAfAABqGAAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
0GUBANBlAQAQ1gAAENYAABCLAAAQiwAAEIsAALCUAQCgCQEAQJYBAECWAQBAlgEAwNoAAMDaAADA2gAAwNoAANBSAAAgmQAA0AEBANABAQAgywAAoIwAAIC7AADgqwAAgLsAAIC7AADgqwAAIEgBAMBRAgCg/QIAYGcBAIA4AQBg5AEA

qdat:
AAAAAAAQAAAAAAKQIAQIEUAQJhgQC6YYSEEVsIDAwnaCTJMCbimKyoHgRAz181fTh8jqFAfWM9NL++HN8La/3SST99varT5WN79c6uj9f73Vmq7ZaenUrf//9v7N//bhjpL+/u/bdT/9zv/927z/+2utrvd//9/z/3/6/f==


formula: Ni P
compound: Synthetic
formula_title: NiP
a: 6.0360
b: 4.8684
c: 6.8788
alpha: 90
beta: 90
gamma: 90
cell_volume: 202.138
crystal_density: 5.893
atoms_sites: ["Ni", "P"]
atoms_x: EN8LAFCYAwA=
atoms_y: 0LYAAAClCgA=
atoms_z: ADgYAPDgBgA=
atoms_occupancy: 0
atoms_u_iso: AH0AAECcAAA=
atoms_aniso_label: ["Ni", "P"]
atoms_aniso_u11: AH0AAGBtAAA=
atoms_aniso_u22: YG0AAKCMAAA=
atoms_aniso_u33: oIwAAMDaAAA=
atoms_aniso_u12: AAAAAAAAAAA=
atoms_aniso_u13: YPD//6APAAA=
atoms_aniso_u23: oA8AAOAuAAA=
pub_title:
 Pressure-induced development of bonding in NiAs type compounds and
 polymorphism of NiP
 Note: P = 1.29 GPa

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEEAACgAAAABQAkACQABAAgCIAMAIIAJICYgQBAEYQCGcVBEABIgmQgIBocIwGopkrUgKgkovFIQ6poUQ8iOy7CS8QCkFE4ZVyht5+WfSUh30ty1P2qysXLU3dl+dO6Ud+V1j5snX==


formula: Ni7 P7
compound: Synthetic
formula_title: NiP
a: 23.801
b: 5.9238
c: 4.8479
alpha: 90
beta: 90
gamma: 90
cell_volume: 683.517
crystal_density: 6.099
atoms_sites: ["Ni1", "Ni2", "Ni3", "Ni4", "P1", "P2", "P3", "P4"]
atoms_x: AKkaANADCQDwowwAAAAAACBIGgBA0AgA4KkRAAAAAAA=
atoms_y: AAcDAIBeAwBgFhsAYCkDALBzEwBg4hIAAAsTANArEwA=
atoms_z: gKIZACDRGAAgcxcAcOA2AHAMBgAgTwQAgG0NAKBqDgA=
atoms_occupancy: 0
atoms_u_iso: oIwAAGBtAAAAfQAAAH0AAAB9AAAAfQAAAH0AAAB9AAA=
atoms_aniso_label: ["Ni1", "Ni2", "Ni3", "Ni4", "P1", "P2", "P3", "P4"]
atoms_aniso_u11: 4KsAAMBdAAAAfQAAQJwAAOAuAACgjAAAYG0AAKCMAAA=
atoms_aniso_u22: QJwAAGBtAAAAfQAAAH0AAAB9AAAgTgAAAH0AAKCMAAA=
atoms_aniso_u33: IE4AAAB9AAAAfQAAwF0AACDLAACgjAAAYG0AACBOAAA=
atoms_aniso_u12: oA8AAAAAAADgLgAAAAAAAMDg//9g8P//AAAAAAAAAAA=
atoms_aniso_u13: oA8AAEAfAAAAAAAAAAAAAOCx//9g8P//INH//wAAAAA=
atoms_aniso_u23: AAAAAEAfAABg8P//4C4AAKAPAAAAAAAAINH//4DB//8=
pub_title:
 Pressure-induced development of bonding in NiAs type compounds and
 polymorphism of NiP
 Note: P = 5.79 GPa

qdat:
AAAAAAAABAAAAAAAACQAAAgAAAIAYABAAAAcEAAEAEIYwgDAERCCAQKDkEFAEbAAAgwIECCZBBslgAsgABBJDArgcYpgiPAhbkEdBEQyAEkELOYLgjnhPkAhohKDaGKsAbpXLBaELxAuaLE7Q2ALyiontDoP1PEXLnQUp5==


formula: Ca Cu10 Te4 As4 O34 H10
compound: Gold Chain mine, Tintic district, Juab County, Utah, USA
formula_title: <missing>
a: 8.9925
b: 10.1291
c: 8.9971
alpha: 102.668
beta: 92.490
gamma: 70.434
cell_volume: 752.989
crystal_density: 4.498
atoms_occupancy: 0
pub_title:
 The role of hydrogen in tellurites: crystal structure refinements of juabite,
 poughite and rodalquilarite

atoms_sites:
["Ca", "Cu1", "Cu2", "Cu3", "Cu4", "Cu5", "Te1", "Te2", "As1", "As2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "H8", "O9", "O10", "O11", "O12", "O13", "O14", "OW15", "H15a", "H15b", "OW16", "H16a", "H16b", "O17"]

atoms_x:
gIQeAFhYMQDYFRIA0O8XADC6KQDgefv/UNUbALjqBwBwBAQAkAEjAAAhOQCwwjwAMDMLAIBfBwAw/CgA8Gk3ABCrHACw2BcAgEkTAPCsFwCA9iQAkIckACAgEAAw7gkAkPkqAKBnAgAg3f3/AF8FAEDCNABA+S8AIAQ2ABC+HQA=

atoms_y:
gIQeABi8MACYXDMAOPQeAAjOMwCIvzAA+CkzAAD1MgAQBy8AmDcwAMCbMACgqzEA8N80AEAyMwBQ9TIAgCUyANDJMwDQdCQAQEcjAFBHNgDAiTMAoHYlAODUJwDwRSQA8PExAIC9IQCgTx8AADQhAGAeIgAgiCAAoMYgAAB0JwA=

atoms_z:
AAAAAIgiAACgOx8AyCAmABhnJgAg4RcAgMkzABhlCgAwRCwAwKIQAMDQCgCAOTcA0EorAIB8FwCQFDMA4GMlAIADJwAQmBsAQAwYAKDDFADQKAcA0MwNACBcBgDggygAkOgYANCcFQBgchQAYMsaAKB7OQAg5joAoFQzAOBgMgA=

atoms_u_iso:
4A8BAIikAABglQAAoMgAAECwAABoxAAAGKEAAKjtAAAohwAAOHIAALD+AABQDgEAYNEAAKDwAAAQ7wAA0M8AAHDfAACw5QAAQA0DAACvAADgxAAAkOIAACDeAQBwQwEAIOQAANB4AgBADQMAQA0DABD8AgBADQMAQA0DAGAcAQA=

atoms_aniso_label:
["Ca", "Cu1", "Cu2", "Cu3", "Cu4", "Cu5", "Te1", "Te2", "As1", "As2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "OW15", "OW16", "O17"]

atoms_aniso_u11:
sK0BACCAAADwbgAAwMEAAFB4AADQhAAAmJ4AADDUAABgYwAAWGEAACCZAAAwwAAAUKoAAICiAACQlwAAUHgAAPC5AACA1AAAUF8AAHCUAADAJQEAEDoBAGDRAACwgQAAIL8CAADuAgBwjgEA

atoms_aniso_u22:
AK8AACAWAQCA7QAAILIAABBTAQAgegEAgM8AACBIAQAgywAAYJ8AAND7AQCAMgIAACwBAKDqAQAw7AEAgJwBADC6AQCQ4gAAMPIAAMA+AQBwrQAAgLUBAGDRAABwwAEAgLUBAAB3AQBA5wAA

atoms_aniso_u33:
AJYAALBoAABghgAA8NIAAIBwAAAQcgAAmI8AAHjNAABYdQAAUGQAAICiAAAgZwAAgLsAAJCXAADwhwAAAGQAAIBwAADQ6AAAoL4AAECcAADw6wAAAPQBAEATAgAggAAAoP0CAOAWBABQDgEA

atoms_aniso_u12:
kOj//+Cx//+AqP//0O7///CN///gf///oKv//yCL//9gw///IMz//4Bd//+ARP//AIP//+BN///Qcf//0KP//4Bd//9A1P//gNr//0C7//9Aov//sAQAABDc//+Adv//YPb+/8Bj//+Qa///

atoms_aniso_u13:
oPb//8js//+o5P//MBEAALDw//+A7v//iAkAALgBAAAQ+v//KPv//0DU///g/P//IAMAAJDP///g4///8PH//0DU//9w5f//IAMAABD1//9w/v//kBoAAKAPAACQ6P//wGP//yDR//8g0f//

atoms_aniso_u23:
0CAAAGBAAADARAAAwEQAAJBMAADwPAAACDQAAEBRAACwMQAAYCwAAMB2AAAgTgAAoCgAAICJAACgjAAAUEYAAFB4AAAwQwAAYFQAACCAAABwSQAAULD//0BRAAAgNQAAIE4AAAAAAABgVAAA

qdat:
AAAAAAAAAAAQoCAABAgEACEFCAFaEQAJADGlYcTFQgFmYsVpSuOqF+aI42Mm85j7+WIO6+92bs72/aP3P7x+8/rna3+zm/1f+//539//96/2v///3//33v///e//+/fe/77/3/f/+hf/Pf1/v9+7f9z///fGXuX5/qdarB==


formula: Fe2 Te2 S O13 H6
compound: Tambo mine, Coquimbo Regioin, Chile
formula_title: <missing>
a: 9.6967
b: 14.2676
c: 7.8748
alpha: 90
beta: 90
gamma: 90
cell_volume: 1089.468
crystal_density: 3.737
atoms_occupancy: 0
atoms_aniso_u11: QIMAAHCUAAAggAAA0IQAAKDXAACghgEA4CICAIA+AAAAfQAAIMsAAAB9AACgCQEA4KsAAOAoAQBAGQEAwFcBAAD6AACg6wUA
atoms_aniso_u22: oCIBAJDiAAAA+gAA0AEBAEDOAAAgSAEAwNoAACBIAQCgCQEAYGcBAMBXAQBAlgEAgLUBAIA4AQAgSAEAYOoAAAB3AQCAMgIA
atoms_aniso_u33: 8IcAAACWAABAnAAAkJcAAMDBAADAVwEAQJYBAOCrAABgbQAAIMsAAAB9AABAnAAAgLsAAMDaAADgqwAA4CgBACBIAQBg5AEA
atoms_aniso_u12: 8PH//8D5//8Q9f//0O7//1AUAABAnAAAwOD//4DB//9g8P//oIwAAIA+AADgLgAAoA8AAGDw///gLgAAQKL//wB9AABg8P//
atoms_aniso_u13: UPv//wAAAABQ+///UPv//yA1AAAgTgAAgET//2Dw//8AAAAAoA8AAEAfAABgbQAAwOD//2Dw//+gDwAAYPD//wB9AABAqP7/
atoms_aniso_u23: cP7//2Dw//+Y+f//UAUAAGAJAABAHwAAQB8AAKAPAADA4P//QB8AACDR//9g8P//4C4AAGDw//8AAAAAoA8AAEAfAADgLgAA
pub_title:
 The role of hydrogen in tellurites: crystal structure refinements of juabite,
 poughite and rodalquilarite

atoms_sites:
["Fe1", "Fe2", "Te1", "Te2", "S1", "OW1", "H1a", "H1b", "OW2", "H2a", "H2b", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "OW13", "H13a", "H13b"]

atoms_x:
SDcwABg+MQAggB4A6NYEADiwKwDAqTYAgH00AMD7OQAwoBYAYGYWAGDRGQCgBDgAsNApAEAZGgDw1AgA4PAaADBrCgDA6ysA0FAqAHDAMwAQrSQAwA8NAGAZDgDAIQoA

atoms_y:
UNcAADhqHABwbRgAiJUFAJCNCgDAlBQAAJQRAECnEwAgCwcAoFAKACAkBwCQLQEAkMMaABDWAAAwPgUAkJcZAJCxHQBA+wUAIB4IAHCqDQAAWw4AUF0RAACaEAAAghQA

atoms_z:
cKADADjjAgBYbQ0AgCINAKB4FABQYAQA4IEHAEAl//+guAEAYHn+/wBTBwCQ7A8AMC4QAPADFgCQ3BoAsCobACCSFgBgQhwAcNsJAGCkFACw3hYAwFsRAGDdFwBgihAA

atoms_u_iso:
8LkAAACvAABIsgAAyLQAAEDOAABgZwEAQA0DAEANAwAwiAEAQA0DAEANAwAQvQAAoKUAACD9AABwxgAAABMBABAIAQDgDwEAgAYBAMAlAQCAOAEAYFsDAEANAwBADQMA

atoms_aniso_label:
["Fe1", "Fe2", "Te1", "Te2", "S1", "OW1", "OW2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "OW13"]

qdat:
AAAAAAAAAAAAAgCQAASAACFAEKaBAKJIQSolUIxyGokTqflOEgfc113byNfTLX3Q1+///uv17MeL+27//9e/2//Pfc//////av7fv/v39/7d/1//3+///9///f//Xf///7f8/+/9//PX3vv79ffr7z/P86/uzZnU4bnBF4==


formula: Fe2 Te4 O12 H3 Cl
compound: Tambo mine, Coquimbo Regioin, Chile
formula_title: <missing>
a: 5.1129
b: 6.6481
c: 9.0079
alpha: 73.347
beta: 78.053
gamma: 76.709
cell_volume: 282.200
crystal_density: 5.017
atoms_sites: ["Fe", "Te1", "Te2", "O1", "O2", "O3", "H3", "O4", "O5", "O6", "H6", "Cl"]
atoms_x: ONoQAEBUBwCopxQA4M0LAMAkFgAAtRgAoGcbAFAvIQCA4gYAgAEGAICpAwAAAAAA
atoms_y: qC00ADDFFADIHgoAEDAkAJBOCACQVxMAoOoaAJBjEQBgYQIAQBkaAMCvHAAAAAAA
atoms_z: 6OshAED6KQAYWwoAYNkgAHCjIwDQJjEAAFcwAHACEABQqRUA8KgHAIC1AQAAAAAA
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AICEHgAACT0A
atoms_u_iso: iHIAAPhwAACwiwAAAJYAAPCgAABwxgAAYOQBACDLAACAiQAAsOUAAICpAwCgIgEA
atoms_aniso_label: ["Fe", "Te1", "Te2", "O1", "O2", "O3", "O4", "O5", "O6", "Cl"]
atoms_aniso_u11: 8G4AADhyAADIjAAA8OsAAHB7AAAg5AAAkBQBAHB7AACgIgEAkC0BAA==
atoms_aniso_u22: iG0AAKhcAAC4sAAAoFoAAKCMAACQlwAAwKgAAGCfAACgvgAAEDoBAA==
atoms_aniso_u33: AH0AADB6AADAcQAAgIkAACDkAABQ9QAAAMgAAGBtAAAQvQAAYAMBAA==
atoms_aniso_u12: oOf//wjz///gwP//YL7//9DV//9g1///wJX//+Dj//+AJQAAMGL//w==
atoms_aniso_u13: kOP//1Dx//8I8///4Mr//3AwAAAQkf//AIP//8D5//+Aj///QLv//w==
atoms_aniso_u23: SOr//7jt//+A3///cP7//5Cd//+g3f//8AoAAFD7///g4///4BUAAA==
pub_title:
 The role of hydrogen in tellurites: crystal structure refinements of juabite,
 poughite and rodalquilarite

qdat:
AAAAAAAAAAAAIAAACAgAAIBBEAgAAggACEIAXCACAEFSABBDMw1CiAIAHAjWmNo1pWvBDW96NOIeAKlLqreu56y2ghWKY7r/HZ367iHnre+02Y/v1/t9pvV/rvb3f3/v/382/v7vue6qn+/ef23//3v9rPm6x+v//6zt3/==


formula: K H C O3
compound: Synthetic
formula_title: <missing>
a: 15.1725
b: 5.6283
c: 3.7110
alpha: 90
beta: 104.631
gamma: 90
cell_volume: 306.626
crystal_density: 2.169
atoms_sites: ["K", "H", "C", "O(1)", "O(2)", "O(3)"]
atoms_x: SBcKAOCrAADYTQcAKMwLAIgEBQCovAQA
atoms_y: KFQBAECgKQDgbh8A+EsgALCHEwBgzisA
atoms_z: iAYSAGCe4//IO/f/kMkFABhO7/9AP+//
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:
 Hydrogen-bond studies. LXXXIV. An X-ray diffraction study
 of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K
 Note: T = 298 K

qdat:
AAAAAAAQAAAAAAIAAAAAgIAEAAAAMAAAAAiCBRABQABgIADIBIgEAIDAKiIBkQKsQAVgVUI4RHbDCIgX+gOAPXAZCHEMAd0lAtrKcIYjUOYiI/IjHqDIm5WE7iNVI6nmLY828+5tITq0RF22JwOxl0ffe5VDz8gfWt96G1==


formula: K H C O3
compound: Synthetic
formula_title: <missing>
a: 15.1538
b: 5.6186
c: 3.6868
alpha: 90
beta: 104.356
gamma: 90
cell_volume: 304.104
crystal_density: 2.187
atoms_sites: ["K", "H", "C", "O(1)", "O(2)", "O(3)"]
atoms_x: qBsKAAD6AABoTwcAQM0LAKgRBQBorAQA
atoms_y: OPgBAMBbKgCI5B8AQCEhAMgPFAA4aSwA
atoms_z: YAESACB55P9gNff/0MAFANBF7/+IM+//
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:
 Hydrogen-bond studies. LXXXIV. An X-ray diffraction study
 of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K
 Note: T = 219 K

qdat:
AAAAAAAQAAAAAAIAAAAAgIAEAAAAMAAAAAiCBIgBQABgEACkAogGAIBgJiChlEJWYANIUmEIRD1hhEgTugDAFWgEgjCMgPZmQu/DKEEx2CsQUdSJhzBOL8jKTSs5K3L6TlvaSP2aqJpmShcfI8C7zaHPmZGoxbGTdyaXFR==


formula: K H C O3
compound: Synthetic
formula_title: <missing>
a: 15.1150
b: 5.6044
c: 3.6609
alpha: 90
beta: 103.980
gamma: 90
cell_volume: 300.931
crystal_density: 2.210
atoms_sites: ["K", "H", "C", "O(1)", "O(2)", "O(3)"]
atoms_x: +CAKAKCGAQCgTgcAuM0LAKgRBQCgqwQA
atoms_y: 2CACAAD4KgDYAiAAUFIhAFggFADwoSwA
atoms_z: 6AASAOBT5f/oKvf/UNwFADAx7/+AIu//
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:
 Hydrogen-bond studies. LXXXIV. An X-ray diffraction study
 of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K
 Note: T = 95 K
 Note z-coordinate of O3 has been modified with a negative sign

qdat:
AAAAAAAQAAAAAAIAAAAAgEAEAAAAEAAAAARCAogAoABgEACiAYgCAIBgFRAg0hIrsAGoShkGJBqxQiQSrIBgCuwCghJEIKtRkTtAyhDozAuYFHUiY8wTivQZo8SOJNzrCwv1MzbMtCdliIX26Ghes2Yr7nR1sX8m6/XBwT==


formula: K D C O3
compound: Synthetic
formula_title: <missing>
a: 15.1948
b: 5.6307
c: 3.7107
alpha: 90
beta: 104.567
gamma: 90
cell_volume: 307.272
crystal_density: 2.186
atoms_sites: ["K", "D", "C", "O(1)", "O(2)", "O(3)"]
atoms_x: YBgKACBIAQDIUwcAcM8LAJAVBQBotgQA
atoms_y: UL0BAOAsKgBwux8AWNwgACjiEwCoJiwA
atoms_z: WA4SAGCY5P9ARvf/mLwFANhg7/+wUe//
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:
 Hydrogen-bond studies. LXXXIV. An X-ray diffraction study
 of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K
 Note: T = 298 K

qdat:
AAAAAAAQAAAAAAQAAAAAgIAEAAAAMAAAAAkCBRABQADAIAFIBJAEAQDASiJCsQSsQA6glUQwiFbDCJAn/AOAWvASCGMcAeklBv2MoIblUMxCQrIjFuFYu6aFtiZlI9NqeY59Yux9IjM8hLrabgfjP0tWq6fDXsgvrX16N7==


formula: K D C O3
compound: Synthetic
formula_title: <missing>
a: 15.1700
b: 5.6183
c: 3.6885
alpha: 90
beta: 104.297
gamma: 90
cell_volume: 304.633
crystal_density: 2.205
atoms_sites: ["K", "D", "C", "O(1)", "O(2)", "O(3)"]
atoms_x: IBwKACBIAQCwUgcA8NELAAAeBQDgrAQA
atoms_y: mCQCAOAsKgDo/B8AgFkhAPg0FACwjCwA
atoms_z: 0AkSAIBj5f/gQff/0LsFAKBX7/9YSu//
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:
 Hydrogen-bond studies. LXXXIV. An X-ray diffraction study
 of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K
 Note: T = 219 K

qdat:
AAAAAAAQAAAAAAQAAAAAgIAEAAAAMAAAAAiCBIgBQACgIADEApAEAQDAKiChqEJWYANQUmIYSDVjhEgl6gGALdgNBDEJAVZmQu+COENRcDUgodSJhzBWL9DSlVNxVmXoTHOW2W0vSRLuUh83I8HuzSLdm6P4x6CTbm8uLR==


formula: K D C O3
compound: Synthetic
formula_title: <missing>
a: 15.1311
b: 5.6054
c: 3.6644
alpha: 90
beta: 103.953
gamma: 90
cell_volume: 301.629
crystal_density: 2.227
atoms_sites: ["K", "D", "C", "O(1)", "O(2)", "O(3)"]
atoms_x: SCEKAIA4AQBgUgcA2NALALAYBQAoqwQA
atoms_y: oDoCAECaKgCoDyAAOHkhAEg1FAAwsiwA
atoms_z: qAQSAAAl5f8QRPf/8NcFANBF7/+wPe//
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:
 Hydrogen-bond studies. LXXXIV. An X-ray diffraction study
 of the structures of KHCO3 and KDCO3 at 298, 219 and 95 K
 Note: T = 95 K

qdat:
AAAAAAAQAAAAAAIAAAAAgIAEAAAAMAAAAAhCAogAoABgEACkAYgCAICgFhBgkhJNUAFIUjEMKDqhwiQkuYBAF9QHAhLMISuxEjfAnBHImAuQKGoi45wTFfgap0mMSJzSEw2mdnyMzCUnkYvdsPCdc2Zz9LhnUl406uXCgy==


formula: Ca2 Fe1.72 Mn.17 Mg.04 Al.07 Si5 H O15
compound: Yakuki mine, Japan
pub_title: Neutron diffraction study of babingtonite at 80 K Note: T = 80 K
formula_title: <missing>
a: 7.497
b: 12.225
c: 6.710
alpha: 86.18
beta: 93.90
gamma: 112.27
cell_volume: 567.231
crystal_density: 3.336
atoms_u_iso: 0
atoms_sites:
["Ca(l)", "Ca(2)", "Fe(l)", "Mn(l)", "Mg(l)", "Fe(2)", "Al(2)", "Si(1)", "Si(2)", "Si(3)", "Si(4)", "Si(5)", "H", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "O(10)", "O(11)", "O(12)", "O(13)", "O(14)", "O(15)"]

atoms_x:
QMoJAIA8EQBgEAMAYBADAGAQAwBwhAsAcIQLALCyLgAADTQA0P4mAMBPLABQCR8AMPUMALApMACwBjoAcAMtAIBRAQBwSgQAsE0qAIBXGQAAojAA4D4nAMDhNQDALgwAcIMgAGCdEQDQiRQAgAIjAA==

atoms_y:
cIM5AJC+HwCATicAgE4nAIBOJwCQXA4AkFwOAEA/AwBQHxMA8MYbAOCKKwBAADMAwNUFACBEPACw5gQAcHEKAGCkFAAw3CUAMKAWAEB2FwCQAh0AYLQiAJAZLgAAeg0AEPosANDCMAAAsQgAMA07AA==

atoms_z:
kFk0AMB0KgAAUzkAAFM5AABTOQDgyjEA4MoxAOA4KACgHiMAAD4wAGAgKgDAkDYAUOofAIB3HAAwxjEAYGkiAHD9LQCwsCYAkEkmALBiMwCAbDsAUGkoAHBpNQCw2h8AQLotADCWOQBwDDgAUD8vAA==

atoms_occupancy:
AAk9AAAJPQDANzAAQGAKAABxAgBAwzgAwEUEAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AA==

atoms_aniso_label:
["Ca(l)", "Ca(2)", "Fe(l)", "Mn(l)", "Mg(l)", "Fe(2)", "Al(2)", "Si(1)", "Si(2)", "Si(3)", "Si(4)", "Si(5)", "H", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "O(10)", "O(11)", "O(12)", "O(13)", "O(14)", "O(15)"]

atoms_aniso_u11:
sBMAADgJAACAEQAAgBEAAIARAAA4CQAAOAkAALgLAABQCgAAOAkAAHgKAAB4BQAAYDsAANgdAADACAAACBEAAIgJAAA4DgAAUAoAAHAIAADICgAAAAoAAMAIAAAAFAAAQAsAAIgJAADYDgAAmA0AAA==

atoms_aniso_u22:
6AgAAIAMAADQEQAA0BEAANARAABwCAAAcAgAAOAGAAAYBgAA4AYAAMgFAACQBgAAcBcAAAgMAAAwDAAAMAcAAJALAABwDQAAoAoAAHAIAAC4CwAAyAUAAKAKAAB4CgAAoAoAAKAKAAAoCgAA+AcAAA==

atoms_aniso_u33:
gAwAAIAMAABgEwAAYBMAAGATAACABwAAgAcAANAHAACwBAAAsAQAAEAGAABgCQAAsB0AANAHAAAYBgAAEA4AAFgHAADQBwAAiAkAAHgKAABgCQAAEA4AAOAGAABABgAA+AcAADARAABICAAAUA8AAA==

atoms_aniso_u12:
2AQAALAEAACQBgAAkAYAAJAGAABwAwAAcAMAABAEAADAAwAA0AIAAEgDAABoAQAAUBQAAIgJAAD4AgAAeAUAADgEAADQBwAA4AYAAJgDAAAwBwAACAIAAEgDAACgBQAAyAUAAEgDAAAYBgAAsAQAAA==

atoms_aniso_u13:
4AEAAPgCAACQAQAAkAEAAJABAAAYAQAAGAEAAHD+//9w/v//AAAAAJABAACQAQAA0AcAAHgAAACo/f//oPv//1j9//8oBQAAyAAAABAEAADA/v//aPz//ygAAADIBQAAQAEAAGAEAAA4+v//IAMAAA==

atoms_aniso_u23:
qP3//zACAADo/v//6P7//+j+//94AAAAeAAAAJABAABw/v//AAAAAJABAABw/v//kAEAALj8///Y////AAAAAND9//84BAAA6P7//5gDAACo/f//qP3//0j+///QAgAAMP3//3D+//9A/P//iAQAAA==

qdat:
AAAAAAAAAIAAAAASABEAEAICAAgBgAQIoADKIiEMAhAAkoIuSGiEkFNio2k0EGDy9RxoEONanQws4vO2I387652FZ/3kqZmxvrF+7ep5v70+tf7fF603r32pv7nx//96+/2n7Xd86zu3//f9/979n6/v//fv/f67/75/vz==


formula: Fe4 O5
compound: Synthetic
pub_title: Discovery of the recoverable high-pressure iron oxide Fe4O5 Note: P = 10 GPa
formula_title: Fe4O5
a: 2.8430
b: 9.700
c: 12.29
alpha: 90
beta: 90
gamma: 90
cell_volume: 338.923
crystal_density: 5.946
atoms_sites: ["Fe1", "Fe2", "Fe3", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
atoms_y: AAAAAID3DwCAzx4AwKQJACBHFgAgMAUA
atoms_z: AAAAADDnBgBAQg8AQEIPAMCRIQDgPicA
atoms_occupancy: 0
atoms_u_iso: gDgBAIA4AQCAOAEAgDgBAIA4AQCAOAEA
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:
AAAAAAAAAAAAAAAAAgAAACAQAAAEAAAAAEgAAAIIIAgQgAUBAhQYgAAsAIACCAAEhogkQCREASACBUqCCwEgkbJhkSigpEoEIQcEJIChQoAo8YioKVjV4AknSYJocCgCIS6hERZgKkYAuAgaAgCYY7I0CVMigMCIIxYhGB==


formula: U Si2.5 O10 K.62 Na.38 H3
compound: <missing>
pub_title: Crystal-structure of weeksite
formula_title: <missing>
a: 7.092
b: 17.888
c: 7.113
alpha: 90
beta: 90
gamma: 90
cell_volume: 902.367
crystal_density: 3.712
atoms_sites: ["U", "Si1", "Si2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "Wat1", "Wat2", "K", "Na"]
atoms_x: AAAAAAAAAAAAAAAAYMwFAAAAAADAngoAAAAAAAAAAAAAAAAA4OwKAAAAAADg7AoA4OwKAODsCgA=
atoms_y: 4BgMAADaFgAAAAAAgIQeAGAlDACASRMA4A8aAGBVBACAhB4AAAAAAAAAAAAg1hMAINYTACDWEwA=
atoms_z: AAAAAAAAAAAgJAcAQDYRAAAjDwAAAAAAwJgLAAAAAACAhB4AgFsQAICEHgCAhB4AgIQeAICEHgA=
atoms_occupancy: AAk9AAAJPQCAhB4AgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AgIQeAAAJPQCAhB4AwOsSAMCYCwA=
atoms_u_iso: gOMAAKjZAAD4xQAAqNkAAKjZAAAwAQEAANsBAOCACADoPQIAECoCAJDyBAAI8AIACPACAAjwAgA=
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:
AAAAAAAAAAACAACBAABAACAkAAAKAEADBkAwgKQAECAMyDhjQRgAEUO4mIlg7gzeI1g4Hg5BAbXNBoAubvC4eGabadHLRZ660IFm7JAndr53Zmw59WA53lfq0e9T4T3q4R0lu/1h/ZQ3dQy+Yl5v/+ftulXzN6n/Py1SDr==


formula: K.6 Na.9 Ca.74 Mn.2 Mg.04 Th.88 Ce.03 Pb.01 Si8 O20
compound: Mont St-Hilaire, Quebec, Canada
pub_title: Structure cristalline de l'ekanite de St-Hilaire, P.Q.
formula_title: <missing>
a: 7.58
b: 7.58
c: 14.77
alpha: 90
beta: 90
gamma: 90
cell_volume: 848.631
crystal_density: 3.291
atoms_sites: ["K", "Na", "Ca", "Mn", "Mg", "Th", "Ce", "Pb", "Si", "O1", "O2", "O3"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABQ5g8AkBEOAICvGwAQmQYA
atoms_y: AAAAAICEHgCAhB4AgIQeAICEHgAAAAAAAAAAAAAAAAAAghQAAIIUADCxDwDwFA8A
atoms_z: AAAAAEBCDwBAQg8AQEIPAEBCDwBAQg8AQEIPAEBCDwCQjAYAAAAAAHAZCAAA9gkA
atoms_occupancy: AJ8kAEB3GwBAlRYAgBoGAIA4AQAAtjUAwNQBAECcAAAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: 0
atoms_aniso_label: ["K", "Na", "Ca", "Mn", "Mg", "Th", "Ce", "Pb", "Si", "O1", "O2", "O3"]
atoms_aniso_u11: kIIBAPh0AQD4dAEA+HQBAPh0AQDQ3gAA0N4AANDeAADQ3gAAuEoCACj6AACARwEA
atoms_aniso_u22: kIIBADgDAQA4AwEAOAMBADgDAQDQ3gAA0N4AANDeAADA1QAAUFgCAHBwAQCgJwEA
atoms_aniso_u33: QNIBAJglAQCYJQEAmCUBAJglAQAwzwAAMM8AADDPAAAwzwAAMM8AAHDjAQAwjQEA
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAB4+///WBsAAPAoAABo8v//
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACQGgAAAAAAAKgRAAAocwAA
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACoEQAAAAAAACA1AAC4jQAA
qdat:
AAAAAAAAAAAAABQAAAAFAAAAQAACIABmAAkAAEAkAEkDKAhgKBaBkAQISqOIpxQaEcQQhmdTIEKnQKRWN1dZ4+SKntExj264Gz2znPhFU2WJb0kucuzFrI/+iH4169RM9Q+/yYThz/ZnXmV7N5D8tu7l16npRmVxyv00F4==


formula: H Cl
compound: synthetic, note this is the deuterated structure
pub_title: Crystal structure of solid hydrogen chloride and deuterium chloride Note T = 77.4 K
formula_title: HCl
a: 5.053
b: 5.373
c: 5.825
alpha: 90
beta: 90
gamma: 90
cell_volume: 158.147
crystal_density: 1.531
atoms_sites: ["H", "Cl"]
atoms_x: oPEEAEBCDwA=
atoms_y: QGAKAAAAAAA=
atoms_z: AAAAAAAAAAA=
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
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAgAAgAEAAABAAAAAAAgBABAAAAAgAAQAIAAACgAIAAIgAABBgAJAAIAICCAAoAgECAAAAAEgBABAOABCGEgAoAgpAYAgCAUIAAgCQwUgkAEULAALBBjBgAASDLAgYsIAsER==


formula: H Cl
compound: Synthetic
pub_title: Crystal structure of solid hydrogen chloride and deuterium chloride Note T = 118.5 K
formula_title: HCl
a: 5.482
b: 5.482
c: 5.482
alpha: 90
beta: 90
gamma: 90
cell_volume: 164.747
crystal_density: 1.470
atoms_sites: ["H", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
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
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAAAgAAAAAAAAAAAQAAAAAAAAAEAAAAAAAAIAAAAAAAEAAAAAAAAAAAAAAgAAAAAEAAAAABAAAAACAAAAAIAAAABAAAAAgAAAAAAAABAAAAEAAAAQAAA==


formula: H Cl
compound: synthetic, note this is the deuterated structure
pub_title: Crystal structure of solid hydrogen chloride and deuterium chloride Note T = 118.5 K
formula_title: HCl
a: 5.475
b: 5.475
c: 5.475
alpha: 90
beta: 90
gamma: 90
cell_volume: 164.117
crystal_density: 1.476
atoms_sites: ["H", "Cl"]
atoms_x: AAAAAICEHgA=
atoms_y: AAAAAICEHgA=
atoms_z: AAAAAICEHgA=
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
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAAAQAAAAAAAAAAAQAAAAAAAAAEAAAAAAAAEAAAAAAACAAAAAAAAAAAAAAQAAAAABAAAAAAgAAAABAAAAAEAAAABAAAAAQAAAAAAAAAgAAACAAAAQAAA==


formula: H12 Cl
compound: Synthetic
formula_title: HCl
a: 5.482
b: 5.482
c: 5.482
alpha: 90
beta: 90
gamma: 90
cell_volume: 164.747
crystal_density: 1.917
atoms_sites: ["H", "Cl"]
atoms_x: wCEKAAAAAAA=
atoms_y: wCEKAAAAAAA=
atoms_z: AAAAAAAAAAA=
atoms_occupancy: 0
atoms_u_iso: GPUGAGgrAwA=
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 phase transition of hydrogen chloride
 Note: this phase is stable above 120 K
 Note: T = 135 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAQAAAAAAAAAAAAAAAgAAAAAAAAIAAQAAAAAAAAAEAAAAAAIAIAAAAAAAEAAAAAIAAAAAAAAgAAAAgEAAAAABAAAAICAAAAAIAAAEBAAAAAgAACAAAAABAAAIEAAAAQAAE==


formula: Sr V3 O11 H8
compound: Molinello mine, Val Graveglia, Liguria, Italy
pub_title: Bassoite, SrV3O7*4H2O, a new mineral from Molinello mine, Val Graveglia, eastern Liguria, Italy
formula_title: <missing>
a: 5.313
b: 10.495
c: 8.568
alpha: 90
beta: 91.14
gamma: 90
cell_volume: 477.657
crystal_density: 2.951
atoms_sites: ["Sr", "V1", "V2", "O1", "O2", "O3", "O4", "Wat5", "Wat6", "Wat7"]
atoms_x: cMYPAGiXLQA4HQ8AwGP//7CPHwBg0C4AsAktAPD1DwCgjwwA0IktAA==
atoms_y: QEIPAEBCDwC4LQEAsAwHAJAiBwAgFf3/QEIPABAIAQBAQg8AQEIPAA==
atoms_z: cG0OABBN/f/4ifv/AMIBADDsAQDwqg8AgB4vAGCFFQDAySAAIGYVAA==
atoms_occupancy: 0
atoms_u_iso: QEUCANDiAQDAogEAIMUBAIDOAQBwjgEAwKIBAEBeAgAgMAUAkH8EAA==
atoms_aniso_label: ["Sr", "V1", "V2", "O1", "O2", "O3", "O4", "Wat5", "Wat6", "Wat7"]
atoms_aniso_u11: IEICAPDlAQAwoQEAkMMBAKDRAQCgnwEAoLgBADBpAgCgdAQAgKMEAA==
atoms_aniso_u22: 8EkCAKDqAQDQsAEAYMsBADDTAQBwpwEAgLUBAKCyAgCAJgQAwMIEAA==
atoms_aniso_u33: IEICAHDZAQDQlwEA4L4BAJDDAQDQZQEAAHcBAGD9AQCg5QYA4BYEAA==
atoms_aniso_u12: AAAAAAAAAACwBAAAgNr//6D2///Q7v//AAAAAMASAAAAAAAAAAAAAA==
atoms_aniso_u13: 0AcAAKAPAACgDwAA4OP///Dx//8gHAAAQO3//0AGAABAHwAAQB8AAA==
atoms_aniso_u23: AAAAAAAAAACQAQAAIOr//3D+//9QFAAAAAAAALDr//8AAAAAAAAAAA==
qdat:
AAAAAAAAAAAAQAABAAACgAQIEEIAgABGIQABCEiFCHiSUAtJBFB8BS4cSLARi1o9fYMHkBR6D7whqsVVze028dcT+12096a3Lzs//f+0uv/fvV/Z/+jbz9/+5Lrj/v53tfP3/7Xar/9377/fp3z/X9dfvf+uT/3/+eH/+5==


formula: Mn6.72 (V1.46 As.54) O16 H8
compound: Pipji, Turtmann Valley, Switzerland
formula_title: <missing>
a: 5.5038
b: 12.2665
c: 10.1055
alpha: 90
beta: 95.559
gamma: 90
cell_volume: 679.038
crystal_density: 3.659
atoms_x: AAAAAHguDgBYuy0AMDQPAHCcIABwnCAAkEgiAPBDAwAAyQQAcGIZAFCSBAAQKSEAgFYVAFAUMgAgywAAoMcLAABrAwAAECcA
atoms_y: gIQeACjwCgAgriIAKK0MAMCjGQDAoxkAeDYaAECtEgAQDRUA0BgSAMBAIgCApikAsMEfAJAUGgDgLRUAoAgWAGAqIABAiC0A
atoms_z: gIQeAJBsMADIhzwAQJIeANA7KwDQOysAkNA1ADArNgDAxxgA0MAoAGAjNgBAPzUA8OgmAIBhKABgQTEAwN8UAKDjMAAAvDQA
atoms_occupancy: AAk9AAAJPQAAJzgAgF85AECOLADAehAAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A
atoms_u_iso: EKQAAIC7AABwlAAA8KAAAHB7AABwewAA4MQAAKDXAADA8wAAkBQBAIDtAADw6wAAoPAAAGAcAQAgPAMAIDwDACA8AwAgPAMA
atoms_aniso_label: ["Mn1", "Mn2", "Mn3", "Mn4", "V", "As", "O2", "O-h1", "O-h3", "O4", "O-h5", "O-h6", "O7", "O8"]
atoms_aniso_u11: 0LYAAACvAACAcAAAQJwAAKBzAACgcwAAgKIAADDZAAAAyAAAgGoBADDAAAAw2QAAIP0AAPDSAAA=
atoms_aniso_u22: IJkAAPC5AADgkgAAgKIAACCAAAAggAAAcN8AANDoAADA8wAA8NIAAKDXAABQ9QAAcMYAAOClAQA=
atoms_aniso_u33: IJkAAMDBAABAtQAAEKQAAOB5AADgeQAA4MQAAODEAADwHQEAwPMAAAAsAQDg9gAA0AEBAODdAAA=
atoms_aniso_u12: YPD//7AdAADg/P//QO3//0AGAABABgAAQAYAAIAMAAAQ9f//AOf//9Du///AKwAAoCgAAABLAAA=
atoms_aniso_u13: sAQAAFDi//9Q+///YAkAAOD8///g/P//IOr//4AMAAAQDgAAMN///4AMAAAgHAAA8Nj//wAZAAA=
atoms_aniso_u23: AOf//4Dz//+QAQAAAAAAAHD+//9w/v//4Pz//zD4///QBwAAILj//0AGAABw5f//UC0AAJAaAAA=
pub_title:
 Argandite, Mn7(VO4)2(OH)8, the V analogue of allactite from the metamorphosed
 Mn ores at Pipji, Turtmann Valley, Switzerland

atoms_sites:
["Mn1", "Mn2", "Mn3", "Mn4", "V", "As", "O2", "O-h1", "O-h3", "O4", "O-h5", "O-h6", "O7", "O8", "H1", "H3", "H5", "H6"]

qdat:
AAAAAAAAAAAAAEAAAgAQhgEAQCAiICBAogQCAAQQonEAg4pE5AEYphrIiLlTiDftmYivszh97od6tua33W76d/n/559i1Gs/u/fv/Uvr/n/z//zz2+vrs9f/v56/9v1m5/rsf/z/7b4e2fv3612L+5aMu589/tnbt+a4+V==


formula: Na4.75 Ca.055 Mn.215 Ti1.415 Nb.255 Fe.08 Ta.005 Zr.055 Mg.055 Si2 P O13
compound: Lovozero alkaline massif, Russia
formula_title: <missing>
a: 5.4170
b: 7.1190
c: 14.487
alpha: 99.957
beta: 96.711
gamma: 90.360
cell_volume: 546.286
crystal_density: 3.171
pub_title:
 From structure topology to chemical composition. IX. Titanium silicates: revision of
 the crystal chemistry of lomonosovite and murmanite, Group-IV minerals

atoms_sites:
["Na(1)", "Na(2)", "Na(3)", "Ca(3)", "Na(4)", "Mn2+(4)", "Na(5)", "Ti(1)", "Mn2+(1)", "Nb(1)", "Fe3+(1)", "Ta(1)", "Fe2+(1)", "Ti(2)", "Mn2+(2)", "Nb(2)", "Zr(2)", "Mg(2)", "Fe2+(2)", "Si(1)", "Si(2)", "P", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "O(10)", "O(11)", "O(12)", "O(13)"]

atoms_x:
2HwKAJAtLgBgWCkAYFgpAIAzKQCAMykACIUOAJAkCgCQJAoAkCQKAJAkCgCQJAoAkCQKANgWLwDYFi8A2BYvANgWLwDYFi8A2BYvAGCuKABYqCcAcN8KAFAYKQDgAicA8K44AOClGgAQTiQAsEo3AMhuGQBI7AcAAF8FAFhnDgAo9jYAkD0PAOAaFAA=

atoms_y:
OIsZALjaNQAgQDsAIEA7APDzGwDw8xsAYCwtAKirOACoqzgAqKs4AKirOACoqzgAqKs4ALiZFwC4mRcAuJkXALiZFwC4mRcAuJkXAPB2DABAFicAOLoNAPguGgA48wsA8HYHALhQBgDIISUA4PEtAIjSLACw7zIAsMwZAJgfAgA4pg0A2GQYAGAUDgA=

atoms_z:
KEcOADDG//8IGRYACBkWABBGGAAQRhgAsFkZANBPDQDQTw0A0E8NANBPDQDQTw0A0E8NALCH//+wh///sIf//7CH//+wh///sIf///DNCgAoHAwASGEaAKgSDgBg+wMAeAcNAFDVDABwHAUAiPoOACA1DwBgmgUAyEcEAFhfFgAg/BoAqNsXAEhHIAA=

atoms_occupancy:
YII7AGCCOwCgrTkAYFsDAGAvNAAA4gQAAAk9AABjLgCghgEA4HUJAMDUAQAgTgAAoIYBAGD6JwDAtgYAgBoGAGBbAwBgWwMAoIYBAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=

atoms_u_iso:
2BIBAPBoAQDoJQEA6CUBAMhFAQDIRQEAoFQBAHh9AAB4fQAAeH0AAHh9AAB4fQAAeH0AAHDLAABwywAAcMsAAHDLAABwywAAcMsAALByAADobAAAyIwAAEDOAACQyQAAIC8BADBWAQBwxgAAcN8AANC2AAAg5AAAwNoAAADIAAAwJAEA0BoBAKA7AQA=

atoms_aniso_label:
["Na(1)", "Na(2)", "Na(3)", "Ca(3)", "Na(4)", "Mn2+(4)", "Na(5)", "Ti(1)", "Mn2+(1)", "Nb(1)", "Fe3+(1)", "Ta(1)", "Fe2+(1)", "Ti(2)", "Mn2+(2)", "Nb(2)", "Zr(2)", "Mg(2)", "Fe2+(2)", "Si(1)", "Si(2)", "P", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "O(10)", "O(11)", "O(12)", "O(13)"]

atoms_aniso_u11:
oAkBAODEAADgWgEA4FoBADChAQAwoQEAgOcBAIBwAACAcAAAgHAAAIBwAACAcAAAgHAAALgUAQC4FAEAuBQBALgUAQC4FAEAuBQBAAh/AAD4fwAAIJ4AABBsAQDA8wAA4A8BANBMAQBgHAEAEL0AABCkAAAA4QAAMD0BAHARAQDwuQAAAKkBAJCqAQA=

atoms_aniso_u22:
EFMBAHD4AADg3QAA4N0AAJD7AACQ+wAAMPIAAEh2AABIdgAASHYAAEh2AABIdgAASHYAAJitAACYrQAAmK0AAJitAACYrQAAmK0AAOBlAADwXwAA2HwAAABkAAAA4QAAQBkBAABFAQAAyAAAIBYBAEDOAACwMAEAkLAAAMCPAABAMgEAgKIAAFAOAQA=

atoms_aniso_u33:
MNkAAEAsAgDQGgEA0BoBAKAiAQCgIgEAMD0BAJiUAACYlAAAmJQAAJiUAACYlAAAmJQAAHCZAABwmQAAcJkAAHCZAABwmQAAcJkAAPh1AACgZAAAUIcAACCZAACQfgAA8E8BAAB3AQCwaAAA4MQAAHCtAAAQiwAAwKgAAACvAADwgQEAABMBANDPAAA=

atoms_aniso_u12:
MMb//1AtAACg+///oPv//5AzAACQMwAAgCUAAJAGAACQBgAAkAYAAJAGAACQBgAAkAYAAJgmAACYJgAAmCYAAJgmAACYJgAAmCYAABgBAAC4AQAAcAMAAJAaAAAQDgAAMI4AAABR//+g9v//4Jj//3BJAADw2P//QAYAAKAoAAAQDgAAYNf//+AVAAA=

atoms_aniso_u13:
YAkAAMCu//8Q9f//EPX//4AMAACADAAA8FUAABgVAAAYFQAAGBUAABgVAAAYFQAAGBUAAAgCAAAIAgAACAIAAAgCAAAIAgAACAIAABATAAD4BwAACBYAALAdAADwCgAAwMf//yCZAABABgAAMBEAAKAPAAAwEQAAgCUAAIAlAACQZQAAcEkAANCj//8=

atoms_aniso_u23:
sDYAALC5//8Y9///GPf//zARAAAwEQAAoFoAAPgbAAD4GwAA+BsAAPgbAAD4GwAA+BsAACgZAAAoGQAAKBkAACgZAAAoGQAAKBkAAMAXAABgDgAAwAgAAHAXAABQFAAAsDYAABAOAABwFwAAgCUAADARAACQAQAAgCUAAFD7//8wEQAAQDgAAIAMAAA=

qdat:
AAAAAAAIAAAAAABgABAEACRABBAIBFAYgAAMUoIgUBYJpESgEeFfAIKkJHcRSG/M3QcNcgHWZDSXPPvXa3UUe3O1lmTZPKxpzrn2fe/p0l3Q+ZW7NOqivM9vP/p5et3O7/WV7/Vf7dr896vd/kWp/7v1bPX27677/v399d==


formula: Na1.645 Ca.105 K.025 Mn.165 Ti1.605 Nb.255 Fe.075 Mg.035 Zr.005 Si2 O11 H4
compound: Yubileynaya pegmatite vein, Karnasut Mountain, Lovozero alkaline massif
formula_title: <missing>
a: 5.3875
b: 7.0579
c: 12.176
alpha: 93.511
beta: 107.943
gamma: 90.093
cell_volume: 439.538
crystal_density: 2.979
pub_title:
 From structure topology to chemical composition. IX. Titanium silicates: revision of
 the crystal chemistry of lomonosovite and murmanite, Group-IV minerals

atoms_sites:
["Na(1)", "Ca(1)", "K(1)", "Na(2)", "Mn(2)", "Ca(2)", "Ti(1)", "Nb(1)", "Fe3+(1)", "Ti(2)", "Nb(2)", "Mn(2)", "Mg(2)", "Fe3+(2)", "Zr(2)", "Si(1)", "Si(2)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "Ow(10)", "Ow(11)", "H(1)", "H(2)", "H(3)", "H(4)", "Ti(1A)", "Ti(1B)"]

atoms_x:
sHQXALB0FwCwdBcA4AEtAOABLQDgAS0AMGYZADBmGQAwZhkAGPUQABj1EAAY9RAAGPUQABj1EAAY9RAAqEI4AGDUOQDwVwgAAN4mAOAVAACQ4zYAUOYoAPDAAwCQ9wkAoGIgABC4HgBwLhEAAG4PAKCdEgAARwkAgOQOAECzEQAgvhcAYMUbAA==

atoms_y:
YIYyAGCGMgBghjIA0FUlANBVJQDQVSUAoNgTAKDYEwCg2BMAmCI2AJgiNgCYIjYAmCI2AJgiNgCYIjYAqA4DAIj8JQDQVAgAUP0HAHDtOACAVzIAoJofALCkKAAAvR8AUFcSADCPNgBQlhQA8EcsACDoEABg0RkAQIwkAMA3MACw1xMAINYTAA==

atoms_z:
QCwMAEAsDABALAwAQO0dAEDtHQBA7R0A0K0OANCtDgDQrQ4AQM4eAEDOHgBAzh4AQM4eAEDOHgBAzh4AaNgPANjLEAAQ2QwA8FgMALCKJACwMw0AMJ4OAJBMGQBgAA4AQAwYALA2GQBAqQIAwF0AAIDH/v9AlgEA4DT//6Ah/f9AbQwAwPERAA==

atoms_occupancy:
QFI2AOCTBACghgEA4BQuAMBFBADA1AEA4PYyAMC2BgBgWwMAgLkqAKDZCABgzAUA4CICAIA4AQAgTgAAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQCAOAEAQA0DAA==

atoms_u_iso:
cI4BAHCOAQBwjgEA0LABANCwAQDQsAEAgNQAAIDUAACA1AAA0DMBANAzAQDQMwEA0DMBANAzAQDQMwEAoNcAAIDtAADgVAIAEE0CADALAQCAnAEAMIICAEBLAQAwaQIAwD4BACAWAQDwSQIA8DACAMC/AgDAvwIAqKACAKigAgCA1AAAgNQAAA==

atoms_aniso_label:
["Na(1)", "Ca(1)", "K(1)", "Na(2)", "Mn(2)", "Ca(2)", "Ti(1)", "Nb(1)", "Fe3+(1)", "Ti(2)", "Nb(2)", "Mn(2)", "Mg(2)", "Fe3+(2)", "Zr(2)", "Si(1)", "Si(2)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "Ow(10)", "Ow(11)", "Ti(1A)", "Ti(1B)"]

atoms_aniso_u11:
8GgBAPBoAQDwaAEA0H4BANB+AQDQfgEAcJQAAHCUAABwlAAAUCcBAFAnAQBQJwEAUCcBAFAnAQBQJwEAsLMAAPDSAADQkQIAUNYBAADhAABQbAIAIFsCAABFAQAgKQIAsP4AAIDtAACg/QIAUDoCAKCMAACgjAAA

atoms_aniso_u22:
IGEBACBhAQAgYQEAsEkBALBJAQCwSQEAwNoAAMDaAADA2gAAUPUAAFD1AABQ9QAAUPUAAFD1AABQ9QAAwKgAAKClAABADQMAoP0CAMAMAQDwuQAAAO4CANAaAQCArwIAkF8BAJD7AABA+gEAwFECAMDaAADA2gAA

atoms_aniso_u33:
wO0BAMDtAQDA7QEA0MMCANDDAgDQwwIAYBwBAGAcAQBgHAEAwIkBAMCJAQDAiQEAwIkBAMCJAQDAiQEA8DYBAOBaAQAQhQEAMKEBAGBOAQBAlgEAcD0CACB6AQBQOgIAQGQBACBhAQDg1wEA8BcCAGAcAQBgHAEA

atoms_aniso_u12:
MBEAADARAAAwEQAAAH0AAAB9AAAAfQAA8AoAAPAKAADwCgAAeB4AAHgeAAB4HgAAeB4AAHgeAAB4HgAAAAAAAIAMAADQE/7/IKwBAKAPAABwFwAA0Pr9//AjAABgsgEAUPv///AKAADQawAAwBIAAPAKAADwCgAA

atoms_aniso_u13:
cJQAAHCUAABwlAAAUEABAFBAAQBQQAEAQFEAAEBRAABAUQAAEHIAABByAAAQcgAAEHIAABByAAAQcgAA8FUAAOBgAABg6gAAQO3//zB1AABQeAAAQM4AAFBfAADgeQAAwF0AAFBfAAAAlgAAsLMAAEBRAABAUQAA

atoms_aniso_u23:
oA8AAKAPAACgDwAAwKgAAMCoAADAqAAAMCoAADAqAAAwKgAA4C4AAOAuAADgLgAA4C4AAOAuAADgLgAAECcAAMArAACQz///0Lz//xAnAACADAAAoPb//zAqAABQyf//EEAAAPAjAACgWgAA8IcAADAqAAAwKgAA

qdat:
AAAAAAAAAgAAAABAABQAEAAAREAQAGATAAAJUACEhEIBWIRIMUwgoCITBIpMCYEK6qtgmiES9gJkUvErpVYfFqLNa3zkxWx0m4H/phz9ypn/qYavf3ll2zs/t1v3fLP+ebuZS3/h6563H7fT/lXb/Tv2Jff7z1+Yv7f90b==


formula: Ca Al F5
compound: Synthetic
formula_title: CaAlF5
a: 5.3361
b: 9.8298
c: 7.3271
alpha: 90
beta: 109.911
gamma: 90
cell_volume: 361.353
crystal_density: 2.979
atoms_sites: ["Ca", "Al", "F1", "F2", "F3", "F4", "F5"]
atoms_x: UMocABADBgAQmQYAQK8zAJBJJgCQ/QgAgI4UAA==
atoms_y: IGgdAGBFDwCAQSUAACsWANBPJgDAKREA8F0HAA==
atoms_z: wAMPAPDj+f/wrwoA0JwVADCuAwBgmwkAEB08AA==
atoms_occupancy: 0
atoms_u_iso: 6D0CAKCfAQDQoAIAKMcBADDcAgBgFgIAwFECAA==
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:
 Structural investigations of beta-CaAlF5 by coupling powder XRD,
 NMR, EPR and spectroscopic parameter calculations

qdat:
AAAAAAAAAAAAAAAAAAEABIAEAAQAABIEQAAIEQQAACKSQQBMAAYAskAKAYEG5qKUmiQOiAfEMRSCbONRPYUMSeyd0dUTJGL8yoborzmdPS2yczz7Hkejy5f+fGv9VqR/ra3/6p9oq/u+e/28rm3/H79m7sH/tXS/q7eMn3==


formula: Na2 Ti2 Si2 O11 H4
compound: <missing>
formula_title: <missing>
a: 5.383
b: 7.053
c: 12.170
alpha: 93.16
beta: 107.82
gamma: 90.06
cell_volume: 439.135
crystal_density: 2.858
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:
 Refinement of the crystal structure of murmanite and
 new data on its crystal-chemical characteristics

atoms_sites:
["Na1", "Na2", "Na3", "Na4", "Ti1", "Ti2", "Ti3", "Ti4", "Si1", "Si2", "Si3", "Si4", "O1", "O2", "O3", "Wat4", "O5", "O6", "O7", "O8", "O9", "Wat10", "O11", "O12", "O13", "O14", "O15", "O16", "O17", "O18", "O19", "O20", "Wat21", "Wat22"]

atoms_x:
cAElAIDmFgCA9w8AEK8sAABBIwCwtxAAAOcYAMC5KwCQpAIAEIwEALA+OQDgCjgAIG8HAHBo//9ALTgAEEQQAHAmPAAwiR4AsMEfAMDtMwAAJjQA4JAqABAVHADAtQIA4AofACBvBwCQihcAcNUKANDfJwBArRIAgGcnAKDSNwAQ+Q8AYAguAA==

atoms_y:
EPkoAEDyEwBQ4zUAwFIGAKBpCgCwQhcAQB8yAKASJQDwQzUAkEAbAHA4BwBwZCEAMJgoAGDqGQBAajIAEB4OALCcIQBgdiQAMOUwAMBWFgAg2jwAEGgKAKArDACgoQkA0KkXAOAMJwDQdxcAIBACACB3JwCw2zwAMDcCABBLEwDgjDMAQGMvAA==

atoms_z:
ALswAOD/CwCQKB8AcOAdACBNLgAwux4AkFwOAJAVHgDQ+SsAoBQtAPCLEADgtQ8AQBIwANBbJAAwayMA8I3//zBiGABgriMAkO4XAOAIMACg1i4A4GI6ACA+JACQGhkAsB0ZAPCjDABAdjAA8M8NAKASDADAKi4AAFsOAEBnDQCQiwIAsLn//w==

atoms_u_iso:
mD4BAEBaAQAgZgEAgEIBAPjFAACo2QAAMKwAAOjBAADA1QAAkN0AAAC+AADIzQAAQFoBAFBUAQCoOAEAWHMCALDbAABAWgEAsDoBAPgaAQBQvQEAgAACAOAoAQAAHQEAkN0AABAXAQBY9wAAyCwBAIjlAACAQgEAKAkBACARAQAIdAEAMGABAA==

qdat:
AAAAAAAAAgAAAABAABQAEAAAREAQAJASAAASYACIhEQCmIiIUdghQEYmCRSkGoIezI7BGiIXvALMtuJXSlxaUsKd8tXRlPD5ZoZ9nB6ud+H1MQ2W/fNLqr0921f1qq/l4//0z37H7z7sb4/TaUef+n/Gj7e3vc9z6u/O/t==


formula: Na2 Zr Si6 O18 H6
compound: Kahn Bogdo, Mongolia
pub_title: Crystal chemistry of elpidite from Kahn Bogdo (Mongolia) and its K- and Rb-exchanged forms
formula_title: <missing>
a: 7.1312
b: 14.6853
c: 14.6349
alpha: 90
beta: 90
gamma: 90
cell_volume: 1532.623
crystal_density: 2.599
atoms_x: kCcbAAjV//8QTx4A2DQvAPDhHgDAZA0A+MU8ADDqKwDwTSsAMGApAKDMHwAYEB4AAMASAKA/EQBQqBEAAH0AAFBnBwA=
atoms_y: GCUOAEBCDwBAQg8AoJMXANjjAgAQ4hcAAKYYABC8FQBg3RIAAJIdAKBWBADojAgASOAdABjWFgCQ6RIAwOgGADB+CwA=
atoms_z: wMYtAICEHgCAhB4AYG4nAMAsJwCYVCcAaAInAMDGLQAoPCMAcBkmAMDGLQDY4CMAeGwlAMDGLQCYhSMASHYjAMDGLQA=
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: UOkCAPDrAACgfQAAoKAAAAidAADAngAAsBcBAPAdAQAgFgEAsDABAAAsAQCQFAEA8AQBAJAUAQDgDwEAgBkCAKD3AwA=
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(1)", "Na(2)", "Zr", "Si(1)", "Si(2)", "Si(3)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "Wat(1)", "Wat(2)"]

qdat:
AAAAAAAAAAAAAAKAoBAAUCAAAhggGKQgzmASIgG4I2RsyZ7Fskwlul8Ba/P/Hlf1+/1vS48///97d/fdv//5/7//f/r//+5/z/27s3vt9632P716f+v8J/N/x+xz39vjuE7cezzeh/ezPNlkzGb2dz9bPzE7SnZwfiBs6J==


formula: Na1.581 Rb.2 Zr Si6 O17.69 H5.38
compound: Kahn Bogdo, Mongolia
formula_title: <missing>
a: 7.1280
b: 14.644
c: 14.642
alpha: 90
beta: 90
gamma: 90
cell_volume: 1528.368
crystal_density: 2.615
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 elpidite from Kahn Bogdo (Mongolia)
 and its K- and Rb-exchanged forms
 Note: Rb-exchanged at 90 deg C

atoms_sites:
["Na(1)", "Na(2)", "Rb", "Zr", "Si(1)", "Si(2)", "Si(3)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "Wat(1)", "Wat(2)", "Wat(3)"]

atoms_x:
0PsaALDS//+Awf//KFUeANg+LwDo2h4A4GINABDMPADw/CsAQEkrAOBkKQBQnx8AkBUeAODVEgCAIxEAkK4RAICJAACwogcAwNoAAA==

atoms_y:
MCEOAEBCDwAgmwgAQEIPAOiRFwC45QIAWNsXAICoGACAuhUAsN0SAOCTHQDwbwQAsIMIAMDbHQAwuRYAEOcSABD9BgBQaAsAAL4KAA==

atoms_z:
wMYtAICEHgBQVSMAgIQeABhwJwDAMScAaFcnAHD1JgDAxi0AcD8jAKAlJgDAxi0AANcjAECGJQDAxi0AgH8jAFBuIwDAxi0AIKUwAA==

atoms_occupancy:
IFgoAAAnOACAGgYAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AMCKNwDA5CgAgBoGAA==

atoms_u_iso:
8BcCAKCGAQAgQgIAuJIAAEDOAADAwQAAAMgAACB6AQAgYQEAUFkBAIBqAQAwVgEAUHIBAFBZAQCQXwEAoFQBAJCRAQBg3gIAAHECAA==

qdat:
AAAAAAAAAAAAAAKAoBAAUCAAAhggCOQgymASIgGYEyJkyZpEkkwk2m8BbSl/HVV06b6lR49d7//7///c6u/pvZ7df9mv/6Y/T/qaub/v57n2L5c+NWt8Ivmvo9Ryb92juEf0ezxOg7KynMy05HJ7Ozs9u5E7KTMwNjBspJ==


formula: Rb1.769 Na.06 Zr Si6 O15.908 H1.816
compound: Kahn Bogdo, Mongolia
formula_title: <missing>
a: 14.2999
b: 14.4408
c: 14.7690
alpha: 90
beta: 90
gamma: 90
cell_volume: 3049.828
crystal_density: 2.913
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 elpidite from Kahn Bogdo (Mongolia)
 and its K- and Rb-exchanged forms
 Note: Rb-exchanged at 150 deg C

atoms_sites:
["Rb(1)", "Rb(2)", "Rb(3)", "Rb(4)", "Rb(5)", "Na", "Zr", "Si(1)", "Si(2)", "Si(3)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "Wat(1)", "Wat(2)"]

atoms_x:
gIQeAICEHgAAAAAAAAAAAICEHgBAQg8AQEIPALDYFwCQxhcAsOEOACBKCQCQSAkAQEIPAMA7DgAAAAAAMJMUAPDkFgCAHhYAgIQeAID0AwAAAAAA

atoms_y:
UFAPANhWCABgNBYAQI8XAHB9CACAZw4AQEIPADiUBgCgSBcAGP4CAID2CwC4AAEAsOYEACBGCADAnQYAEF///+DDFQAgVwsAYNIEAOAaFADAmAsA

atoms_z:
0BUfADCOIwBYTgQAUHkEACBwJADAxi0AgIQeAPgjFgAg5ScAeFsnALgBGQCQXhYAwMYtACB7IwBgZhYAUPglAAhbLgBYdBoAcAoXAEDeDgAgvSwA

atoms_occupancy:
YNIEAMDGLQBAOyUAgG0NAMC2BgCAqQMAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AICoGACAGgYA

atoms_u_iso:
4CICAEATAgAQTQIAoHQEAOAKBgDgFgQAEJ8AAMjXAACQ2AAA4M4AAOCMAQAQhQEA4KUBAFCLAQCAzgEAEIUBAIC1AQBwXAEAQH0BAOCfAgCggAIA

qdat:
AAAAAAAAAAAAEAWAQEAAKBACwiAwIrQPuMgmnGpilx+/jhfu8Aj3+2vN7Wv/5d//+//3r35u/9+7//9d69/e/ftXZ/Urv3/TfmfanfuozX1AC4FEEwIACaAAAQAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Mg.5 Al6 S7 O64 F6 H72
compound: La Fossa crater, Vulcano, Aeolian Islands, Italy
formula_title: <missing>
a: 22.010
b: 22.010
c: 9.238
alpha: 90
beta: 90
gamma: 120
cell_volume: 3875.687
crystal_density: 2.068
atoms_aniso_u11: 8MYCAFDcAABQJwEAsDABAMBwAQDw3wIAQEUCAODwAQAwEgQA8DACAACpAQBwQwEAkEACAIC1AQBgmQEAIBYBAADuAgA=
atoms_aniso_u22: 8MYCAMAlAQBwKgEAsDABAIB9AgBQQAEAgGoBALDyAgAwEgQAkA4CAHB1AQCghgEAwJwCAABeAQBgEAMAYP0BANDcAgA=
atoms_aniso_u33: oNMJAJD7AACABgEAkHgBAHDTAgCQqgEA4CgBAEAAAQCAGQIAcKECAKBOAgAgxQEAAPoAALD+AACggAIA8E8BADDsAQA=
atoms_aniso_u12: QGQBADB1AADAqAAAIJkAAKA7AQCgKAAAECEBAPCzAQDgCQIAEGwBAOB5AAAggAAAANsBANCEAAAgegEAYIYAAGD9AQA=
atoms_aniso_u13: AAAAAHD+//+g3f//AAAAAIDa//9QZf//kBoAAICo//8AAAAAwEQAAPAjAADAjwAA0CAAADDf//8wXAAAQFEAAABq//8=
atoms_aniso_u23: AAAAANAHAAAg6v//AAAAAGAP//+gQQAAAM7//zCt//8AAAAAcGIAACBt//8A5///MEMAAHDl///QZQEAYAkAAIBE//8=
pub_title:
 Cossaite, (Mg0.5,_)Al6(SO4)6(HSO4)F6*36H2O, a new mineral
 from La Fossa crater, Vulcano, Aeolian Islands, Italy
 Note: H atom in HSO4 group was not located

atoms_sites:
["Mg", "Al", "S1", "S2", "O1", "O2", "O3", "O4", "O5", "O6", "F", "Ow1", "Ow2", "Ow3", "Ow4", "Ow5", "Wat6", "H1a", "H1b", "H2a", "H2b", "H3a", "H3b", "H4a", "H4b", "H5a", "H5b"]

atoms_x:
VVgUAIjjFgC47wwAVVgUAOD9CADIQQ8AkNwLANCxDwBVWBQAsLoSAIAMFAAw0hsA6EMVAIDPGQCo6RgA0P8RADjWFADgHBwAAHgeADDYFQCw9hIAwFcaAKC+GQCgtxYAQJAbAJC6DwBQ2hEA

atoms_y:
q7AoALhJNQCwgzoAq7AoADg9OgBQVAEASK42AODQOgCrsCgA2HkrAMCqMADoCDcAsGw4ADBZOgDIpTIA8IEzAGiwLQAQ/DQAUJk5AIAtOQBw7TgA0Oo6AED2PADwYTAA8LkyANCpMACArzQA

atoms_z:
ODVHANCSFQB4NwoAMDwqACCWDQDYqgQAmOUEABikEQBw8jMAkBEnAGAxDwDomg4AoCQOAMBQHAAAiB0A6LQcACDFAQBAQQsAoLUOAOAXCABgEw8A8GoiAMC1GwAAtyAAQO4cACAjHADAJyIA

atoms_occupancy:
gIQeAAAJPQAACT0AgIQeAAAJPQAACT0AAAk9AAAJPQCAhB4AgIQeAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
gCAFALADAQBoFAEAsEkBAHAkAgDAUQIAoIYBAHDAAQAAawMAUCECAHDyAQDwmgEAAKkBAJB4AQAAPwIAIJMBAOBUAgDgFgQAYNgDAEB4BgBgzAUAgKkDAKB0BADAtgYAoGIHAMBLAwCgegMA

atoms_aniso_label:
["Mg", "Al", "S1", "S2", "O1", "O2", "O3", "O4", "O5", "O6", "F", "Ow1", "Ow2", "Ow3", "Ow4", "Ow5", "Wat6"]

qdat:
AAAAAAAAAEAACAABEAEgAABICQEgECQUCgoKBBwgYUMCKKKKMUYoQjCIZzGUxGczMZmZmYmTMVRiVSpmzbJo2iySTIbZbZC2mjNgb0tpRinaApWkGdI1ToVioVikBCoohREEgQiACgAMAAQAAgAAAAAAAAAAAAAAAAAAAA==


formula: As2 S3
compound: Palomo mine, Castrovirreyna Province, Huancavelica Department, Peru
pub_title: Anorpiment, As2S3, the triclinic dimorph of orpiment
formula_title: <missing>
a: 5.7577
b: 8.7169
c: 10.2682
alpha: 78.152
beta: 75.817
gamma: 89.861
cell_volume: 488.377
crystal_density: 3.346
atoms_sites: ["As1", "As2", "As3", "As4", "S1", "S2", "S3", "S4", "S5", "S6"]
atoms_x: oN4XAEB6MQCA0hYAWBQ5ADj6NgCAeh4A+BAuAHhmAwB49xIA2NcOAA==
atoms_y: MB4WAJiyCgAobSkAaLg0AHgnOACQLAcAYMolAFDCEAC4Si8AqOMZAA==
atoms_z: 6AcpAHgYMwAQ4DIA4M4oALChNQDAGy4AcKgtAFA0JgCYBSYAsL81AA==
atoms_occupancy: 0
atoms_u_iso: kH0BACh8AQCYfwEAKHcBAMC7AQAA2wEAwNQBAHCnAQCwrQEAIMUBAA==
atoms_aniso_label: ["As1", "As2", "As3", "As4", "S1", "S2", "S3", "S4", "S5", "S6"]
atoms_aniso_u11: sHsBABCeAQDAogEAMKEBAOBUAgDQfgEAcHUBAMC7AQDQfgEAYC8CAA==
atoms_aniso_u22: 4EEBAEBLAQAgSAEAEDoBAMBXAQAwVgEAsEkBAPCzAQAgxQEAgGoBAA==
atoms_aniso_u33: 0LABADC6AQDgvgEAcKcBAMCiAQDAAAMAQPQCAJCqAQAwugEAgJwBAA==
atoms_aniso_u12: yOf//ygtAAAwPgAAsEUAAABkAACwNgAAADIAALAEAADQOQAAwMf//w==
atoms_aniso_u13: GLb///iK//+wjP//EG7//9BY//9QM///8Fv//6Bg//+Qtv//QLv//w==
atoms_aniso_u23: 2KX//+hU//94Uf//WKP//0Ci//9APv//MDD//6CS//9wmv//YKX//w==
qdat:
AAAAAAAAAABAIAEAAABQAEogHAgAAgQCowAAZEMEYJUqRggggcGNrNyg6O+CTtH4954+DSRcr3/4H2pQX9yq9f3XavOr927/3L/9bzO93/X7/7fz++//1+Pb//vv+/3P/3/3/f7tvf7Pb72ep+/72z/uGvq6O/ubr9WOs9==


formula: (Y.4 Nd.15 Ce.15 Ca.15 Th.15) (V.92 As.08) O4
compound: Montaldo di Mondovi, Italy
pub_title: Wakefieldite-(Y) from Montaldo di Mondovi (Italy): new data and crystal structure
formula_title: <missing>
a: 7.2591
b: 7.2591
c: 6.4255
alpha: 90
beta: 90
gamma: 90
cell_volume: 338.589
crystal_density: 4.628
atoms_sites: ["YA", "NdA", "CeA", "CaA", "ThA", "VT", "AsT", "O"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_y: wMYtAMDGLQDAxi0AwMYtAMDGLQBAQg8AQEIPAIBRGgA=
atoms_z: IKEHACChBwAgoQcAIKEHACChBwBg4xYAYOMWAACADAA=
atoms_occupancy: AGoYAMAnCQDAJwkAwCcJAMAnCQAAJzgAAOIEAAAJPQA=
atoms_u_iso: QJwAAECcAABAnAAAQJwAAECcAACgjAAAoIwAAOAoAQA=
atoms_aniso_label: ["YA", "NdA", "CeA", "CaA", "ThA", "VT", "AsT", "O"]
atoms_aniso_u11: CKwAAAisAAAIrAAACKwAAAisAAAgowAAIKMAAJh1AQA=
atoms_aniso_u22: CKwAAAisAAAIrAAACKwAAAisAAAgowAAIKMAAJj4AAA=
atoms_aniso_u33: wHEAAMBxAADAcQAAwHEAAMBxAAA4VAAAOFQAABj7AAA=
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_aniso_u23: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAPgbAAA=
qdat:
AAAAAAAAAAAAAAAAAAAAABAAAAAABAAAAAAAQAEABAAAAAIAAAAgAAEAgCEAACAAEYAAAIAIAAgABgAIEECAAAEyAIQTIBAACAQBFAIAkAQRJAAAUBEtAEEiAApQIIUAKhJAGiiiCQigCKkhOFGZACYEppQqlAqQIgRdQA==


formula: Al Na C O5 H2
compound: Terlano, Bolzano, Italy
pub_title: Dawsonite: new mineralogical data and structure refinement
formula_title: <missing>
a: 6.759
b: 5.585
c: 10.425
alpha: 90
beta: 90
gamma: 90
cell_volume: 393.533
crystal_density: 2.430
atoms_sites: ["Al", "Na", "C", "O1", "O2", "O3", "H"]
atoms_x: AAAAAEBCDwAAAAAAAAAAAAAAAACwDQsA4MgQAA==
atoms_y: AAAAAMDGLQBAQg8AQEIPAKDkAgBAQg8AQEIPAA==
atoms_z: gIQeAEBCDwDgag8A4BcIAEBDEwAgCyAAwCwdAA==
atoms_occupancy: 0
atoms_u_iso: 2HIAALgyAQCYigAAYPkAAPi7AABokgAAcOkAAA==
atoms_aniso_label: ["Al", "Na", "C", "O1", "O2", "O3"]
atoms_aniso_u11: +LsAAPCfAQAYjQAA+CQBAOBBAQDItAAA
atoms_aniso_u22: 6FMAAJAPAQB4pQAAIFwBAHCAAABIhQAA
atoms_aniso_u33: wEQAAFjoAADgbwAASGcAAOBvAAAQgQAA
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA
atoms_aniso_u13: AAAAAACRAAAAAAAAAAAAAAAAAAC4EAAA
atoms_aniso_u23: ePv//wAAAAAAAAAAAAAAAKgbAAAAAAAA
qdat:
AAAAAAAAAAAAAAAAAAEAQIAAAAAAAAAkABAEBGAAQBEAAAA0CAGAGCgoAQAAMDgRU0BBEABklBA6AW4QIU5boQWADokSIw6cQbEeseQZiYMY85BT1Q8Qa0mmBQRV1v4CvU4q0DCudhZFHazDp+4ORmpepbGubG69na4v9S==


formula: Si6 Mg3.592 O19 H6
compound: Batallones, Madrid, Spain
pub_title: Variability in sepiolite: Diffraction studies Note: Sample BAT225 Note: T = 225 C
formula_title: <missing>
a: 13.2608
b: 27.0559
c: 5.2671
alpha: 90
beta: 90
gamma: 90
cell_volume: 1889.745
crystal_density: 1.989
atoms_x: ULMLAFCUDACwAQ0AAAAAAAAAAAAAAAAAAAAAAEBCDwCwlQUA8KEEAOC5BgCwCBAAMGwOAHA0EABAVRAAEPAEAHC0AwA=
atoms_y: gM4BAFCsCADw2wsAQGQBAPCCBQCgCwkA8FgMAEBCDwBgmQEAIBgJAAADDADQUgAA0LEFAAAPCgCANAoAcEQFAIBhDwA=
atoms_z: YJUjAIBsIgCgdAQAQEIPAMDGLQBAQg8AwMYtAGBJBgAAKCMAAC4iAMDCBAAA/xQAwIUjAMDlEwDgCDAAwEUEAMB/JAA=
atoms_occupancy: AAk9AAAJPQAACT0AQM82AEDPNgBAzzYAQM82AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: EFkAABBZAAAQWQAAIAcBACAHAQAgBwEAIAcBALDbAACw2wAAsNsAALDbAACw2wAAsNsAALDbAACw2wAAsNsAALDbAAA=
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", "Mg1", "Mg2", "Mg3", "Mg4", "O9", "O1", "O3", "O4", "O5", "O6", "O7", "O8", "O-H2", "Wat10"]

qdat:
AAAAAAACAAAAAAAFICACQKRwIiMBRCA/kiPQE2SR/bz+5m/u3F79jXrX+Wxd7b77/0qv+/Zu35b8+r+vv/d/ff57/11tPfj+H3R//vfq/+X7rc65+ftMqptv9fffu/+39tOWrkQ1oyE/dfv3+899ZGskxrmQ/mib/2/vs9==


formula: Si6 Mg3.592 O22 H12
compound: Batallones, Madrid, Spain
pub_title: Variability in sepiolite: Diffraction studies Note: Sample BAT25 Note: T = 25 C
formula_title: <missing>
a: 13.3067
b: 26.9720
c: 5.2664
alpha: 90
beta: 90
gamma: 90
cell_volume: 1890.155
crystal_density: 2.178
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", "Mg1", "Mg2", "Mg3", "Mg4", "O9", "O1", "O3", "O4", "O5", "O6", "O7", "O8", "O-H2", "Wat10", "Wat1", "Wat2", "Wat3"]

atoms_x:
IAYMACAZDQAQpwwAAAAAAAAAAAAAAAAAAAAAAEBCDwCwHgQA8KcDAHDaBQCwcg8AMJgPAAAdEABwuBMA4L8FABCMBABwYwQAAAAAAAAAAAA=

atoms_y:
EJ4BAPCJCABA1wsAIKwBAICdBQDw7QgAcGUMAEBCDwAwPQEAIGkIAFCzCwBg8P//cJUEALDhCQCw4QkAcCsFABD5DwDwNhoAgCImAMAsHQA=

atoms_z:
gGYjAEDKIgBABwQAQEIPAMDGLQBAQg8AwMYtAABfBQBARyMA4NkiAAB3AQCgDhUAYBIkAGCKEABA7TEAAOIEAEDWIABgxgYAQEIPAEBCDwA=

atoms_occupancy:
AAk9AAAJPQAACT0AQM82AEDPNgBAzzYAQM82AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQDAxi0AwMYtAMDGLQA=

atoms_u_iso:
eOsAAHjrAAB46wAAoEABAKBAAQCgQAEAoEABAHjrAAB46wAAeOsAAHjrAAB46wAAeOsAAHjrAAB46wAAeOsAAHjrAADIJAQAyCQEAMgkBAA=

qdat:
AAAAAAABAAAAAAAGQEAEIKRoIiEBRCB/kmFQE2rxe7z15mf7XD3pnntXcVn3/bT3/V839yzvr2v40zvd7939ufZ/fl5yfdnsNmjv/v/s9u1/rt650uqYzRWv9f7/uv97dfMXrkR5piJ/fb3+/s15pHdEhtmRbGkfvy/7s1==


formula: Si6 Mg3.864 O19 H6
compound: Grant County, New Mexico, USA
pub_title: Variability in sepiolite: Diffraction studies Note: Sample GRA225 Note: T = 225 C
formula_title: <missing>
a: 13.3317
b: 27.049
c: 5.2694
alpha: 90
beta: 90
gamma: 90
cell_volume: 1900.194
crystal_density: 2.001
atoms_x: YCUMAFCtDABA0QwAAAAAAAAAAAAAAAAAAAAAAEBCDwDQfwUAsOYEABCMBACgSw8AID8PAAAXEQAweRAAgIoEADA+BQA=
atoms_y: sK0BAFCTCADQ8QsAEDQCAABfBQAg/wgA4DEMAEBCDwCwlAEAgNYIAEAJDABwMAAA4FsFADAgCgAAQQoAUEEFAHCeDwA=
atoms_z: QMQjAKC6IgCAJgQAQEIPAMDGLQBAQg8AwMYtAICdBQBgjyQAQMQjAIAsAwCgFBQAwH8kAIBJEwAAUTEAYNIEACD/IQA=
atoms_occupancy: AAk9AAAJPQAACT0AwPU6AMD1OgDA9ToAwPU6AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: MAsBADALAQAwCwEA4B4BAOAeAQDgHgEA4B4BAODJAADgyQAA4MkAAODJAADgyQAA4MkAAODJAADgyQAA4MkAAODJAAA=
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", "Mg1", "Mg2", "Mg3", "Mg4", "O9", "O1", "O3", "O4", "O5", "O6", "O7", "O8", "O-H2", "Wat10"]

qdat:
AAAAAAACAAAAAAAGQEAEQKiwIiMBhCBvImOgJayi/1zv7EvbuHbqlnaW4nm7e3T9WV4v/31fLl/p9n/Xu9V7Mf7+/vxm/bvYatHL/f/49Kn325z7tfc5ijdf/v39d/f2/eItXIxrTEL93en/f557SK5EjbEi1NI7f1939p==


formula: Si6 Mg3.864 O22 H12
compound: Grant County, New Mexico, USA
pub_title: Variability in sepiolite: Diffraction studies Note: Sample GRA25 Note: T = 25 C
formula_title: <missing>
a: 13.3638
b: 27.0034
c: 5.2716
alpha: 90
beta: 90
gamma: 90
cell_volume: 1902.352
crystal_density: 2.187
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", "Mg1", "Mg2", "Mg3", "Mg4", "O9", "O1", "O3", "O4", "O5", "O6", "O7", "O8", "O-H2", "Wat10", "Wat1", "Wat2", "Wat3"]

atoms_x:
0DwMAHDJDABQlAwAAAAAAAAAAAAAAAAAAAAAAEBCDwBAAQUAQAcEALDHBQDQJBAAID8PAHAbEAAgRhIAcF0FAIBYBAAw4AMAAAAAAAAAAAA=

atoms_y:
sK0BANCfCACA9gsAYIABACCUBQAQ2AgAkGgMAEBCDwAQUwEAEI0IAFAXDABwSQAA0AIFAHDbCQCAAgoAkBUFADD8DwAgshkA0P4mABBBHQA=

atoms_z:
wIUjAKA3IwAgswQAQEIPAMDGLQBAQg8AwMYtAOAQBQDg0yMAIHYjAOCZAwAgyhUA4FAkAECtEgCg7y4AILMEAAC3IABg2AMAQEIPAEBCDwA=

atoms_occupancy:
AAk9AAAJPQAACT0AwPU6AMD1OgDA9ToAwPU6AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQDAxi0AwMYtAMDGLQA=

atoms_u_iso:
kOcAAJDnAACQ5wAAmD4BAJg+AQCYPgEAmD4BAFCgAABQoAAAUKAAAFCgAABQoAAAUKAAAFCgAABQoAAAUKAAAFCgAACY1wMAmNcDAJjXAwA=

qdat:
AAAAAAABAAAAAAAGQEAEQKioIiMBhCBvJGNgJa1i21TbbEvyvHnytvaW4nPue3zV+Xxv+mleL7fx7H992796Yfzd+/jHq7NQzJHa7d65/bvvvb2zae1ZGm2213t//e/n68Y/bJjVjIWv//v/u77rkXpJitMj+WR37t7f95==


formula: Si6 Mg3.84 O19 H6
compound: Fauske, Nordland, Norway
pub_title: Variability in sepiolite: Diffraction studies Note: Sample NOR225 Note: T = 225 C
formula_title: <missing>
a: 13.3765
b: 27.0850
c: 5.2757
alpha: 90
beta: 90
gamma: 90
cell_volume: 1911.399
crystal_density: 1.987
atoms_x: AE4MAGCJDACgXQwAAAAAAAAAAAAAAAAAAAAAAEBCDwAgMAUAsM0EANBNBQBwCA8AQN4OAABVDwAgIBAA4CkFAPDsBAA=
atoms_y: MLoBACCbCAAQ+AsAoOoBALBjBQAQ8QgA0FUMAEBCDwAwugEAYLoIAMAVDABwMAAAUFoFANAvCgAAcwoA4CkFAPDDDwA=
atoms_z: oLQjAODZIgDgkwQAQEIPAMDGLQBAQg8AwMYtAGDSBACAYCQAQEcjAKB6AwDgMxQAQL4kAMBoEwBAdjAAgCAFAKA9IgA=
atoms_occupancy: AAk9AAAJPQAACT0AAJg6AACYOgAAmDoAAJg6AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQA=
atoms_u_iso: UPUAAFD1AABQ9QAAuNMAALjTAAC40wAAuNMAAJDnAACQ5wAAkOcAAJDnAACQ5wAAkOcAAJDnAACQ5wAAkOcAAJDnAAA=
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", "Mg1", "Mg2", "Mg3", "Mg4", "O9", "O1", "O3", "O4", "O5", "O6", "O7", "O8", "O-H2", "Wat10"]

qdat:
AAAAAAACAAAAAAAGQEAEQKiwJEMDhCCvJMOgJtXi37Tr1J/2uOv3LOUv4rNu/ejf8vzffvq+Xb9jTKrdf/f2w+39/fHNc2KRXaO/9//x6XfvK1dnU/myNFqr/er/6/fvs8xa2THqiQt//9X/dzTXEfTTHKZH8sh/+73u7X==


formula: Si6 Mg3.84 O22 H12
compound: Fauske, Nordland, Norway
pub_title: Variability in sepiolite: Diffraction studies Note: Sample NOR25 Note: T = 25 C
formula_title: <missing>
a: 13.4074
b: 27.0244
c: 5.2767
alpha: 90
beta: 90
gamma: 90
cell_volume: 1911.891
crystal_density: 2.175
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", "Mg1", "Mg2", "Mg3", "Mg4", "O9", "O1", "O3", "O4", "O5", "O6", "O7", "O8", "O-H2", "Wat10", "Wat1", "Wat2", "Wat3"]

atoms_x:
YCUMADDDDACwOQwAAAAAAAAAAAAAAAAAAAAAAEBCDwBAfgUAoHQEALD/BADweA8AkKcOAMDqDgBQ/w8A4EIFAFDEBADw2QMAAAAAAAAAAAA=

atoms_y:
AKkBAFCTCABwAQwAwNQBAPBpBQAw2wgAEHUMAEBCDwCQkQEA8IkIADD7CwCQZQAA8NMEAAAoCgBAYAoAsBgFALDvDwCw8RcAYOcmALCbHQA=

atoms_z:
YJUjAMAIIwAA4gQAQEIPAMDGLQBAQg8AwMYtACCzBADAiyIAYJUjAMA/BQCAQxQAoK4kAGByFAAAXS8AIK0FACD/IQBg+TwAQEIPAEBCDwA=

atoms_occupancy:
AAk9AAAJPQAACT0AAJg6AACYOgAAmDoAAJg6AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQDAxi0AwMYtAMDGLQA=

atoms_u_iso:
sHwAALB8AACwfAAAcJQAAHCUAABwlAAAcJQAAABfAAAAXwAAAF8AAABfAAAAXwAAAF8AAABfAAAAXwAAAF8AAABfAADIGgQAyBoEAMgaBAA=

qdat:
AAAAAAABAAAAAAAGQEAEQKiwJEIDhCC/RKPAJzXi35Tr1JvlOPv3bWUXxLeq/fm+8nnf9ur+X17j2L17f3b/w+u3/vHOdWah26Nf3//T+Xffc3tu1vrSONNu7f7/6+9+90h22jGtGQt93/VWd2TfEfWiOcqHVUi/ez9+2X==


formula: Ca7 Si3 O15.109 C H.218
compound: Birkhin gabbro massif, Eastern Siberia, Russia
formula_title: <missing>
a: 18.7872
b: 6.7244
c: 10.4673
alpha: 90
beta: 90.7880
gamma: 90
cell_volume: 1322.237
crystal_density: 3.108
pub_title:
 Galuskinite, Ca7(SiO4)3(CO3), a new skarn mineral from the Birkhin gabbro massif,
 Eastern Siberia, Russia

atoms_sites:
["Ca1", "Ca2", "Ca3", "Ca4", "Ca5", "Ca6", "Ca7", "Si1", "Si2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "C", "Wat"]

atoms_x:
QHQPACgjAACwjRwAaFoLAEgc+/+4fhkAqOMPAIjHGQBwhQoAaH4FAPivFgCYLRcAgBkgAFAfHQC4bQwAuO8MADC3+v+ASvT/IG0EAPiYCgAYVAIAMGIEANhgEgBYrhIASMIYADCiFADAlBQA

atoms_y:
wME8APAZHgDoZTkAOOAUABjEFADgQw4ASDkfAPi2LQA47CsAKI4NAOAKOAAglSIAMA0JANCnKABgVAAA4HkyANBvEAAAtBQA4FY8AJDsDwDArRQA4IQTAED4EgAwnxIAcBURAFBXEgCgkCkA

atoms_z:
SBoCAEAY7v8AaQ8AMAcPAPjB//8YhP//EMv8/wj4//9oZvD/8GQAAMDhAwCwx/v/YIAGAAirBgCYdw4AkLT3/7BGDgB4Fvn/cEkAADCB/v+4NPr/+OoIAGBCCACwThUAUG8OANCtDgAgcQ8A

atoms_occupancy:
AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAgpwYA

atoms_u_iso:
2KQAAMigAACQsAAAcLwAALC9AADQygAAoKAAADh8AABofgAAmIAAAKDXAACgvgAAAMgAANC2AACQsAAA4N0AANDPAAAAyAAAUNwAAHDGAABwxgAAkMkAALDMAADQzwAAcPgAAJCwAACAtQEA

atoms_aniso_label:
["Ca1", "Ca2", "Ca3", "Ca4", "Ca5", "Ca6", "Ca7", "Si1", "Si2", "Si3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O14", "O15", "C"]

atoms_aniso_u11:
8LkAAACvAABg6gAAwMEAACDLAACwmgAAkJcAAAB9AADAjwAAIIAAAHDGAACgpQAAUNwAANC2AACQ4gAA4A8BAGCfAABw+AAAQOcAAJCXAACwzAAAMNkAALDlAABQwwAAcK0AACCZAAA=

atoms_aniso_u22:
AJYAAMCPAABQkQAAkJcAAGCGAACA7QAAcJQAADB1AABAagAA8G4AACDLAADQtgAAAOEAAJCwAAAggAAAUMMAACCyAAAwpwAAkJcAAPC5AABAzgAAkMkAACDLAAAQ1gAA4A8BAIC7AAA=

atoms_aniso_u33:
0J0AABCkAAAAlgAAUNwAAEDnAAAw2QAA0LYAALCBAACwgQAAUJEAAOD2AABw3wAAsJoAAIC7AACQsAAAcMYAAIAfAQBguAAAQBkBAGADAQDwuQAA8LkAAEC1AAAQ1gAAcCoBAKC+AAA=

atoms_aniso_u12:
0AIAAGjy///oAwAAwAgAAIgJAABY+P//+AcAAEAGAABQ+///4Pz//xBAAADA4P//wMf//0AfAABQ4v//oA8AAAAAAADQIAAAsOv//wDn///AEgAAoA8AAJABAAAAAAAAgAwAAPAKAAA=

atoms_aniso_u13:
cA0AAPgWAAAgHAAAsP///6gCAADQBwAAYA4AABAOAADgFQAAMBEAAHAXAADAEgAAgCUAAPAKAADgFQAAkM///3AXAAAwEQAAABkAAJAaAABQ+///0CAAAIDz//9wFwAAcBcAAPAKAAA=

atoms_aniso_u23:
GO3//7j3//+A/f//6P7//3j2//+wTwAA0P3//wAAAACQAQAA4Pz//wDn//8A5///ABkAAJAaAACQAQAAAM7//5ABAAAA5///UPv//8ASAAAQJwAAoN3//1AUAABA7f//wPn//5ABAAA=

qdat:
AAAAAEAAAAAQAAAAGAEYhCJgAooRAQUSiVuKBlqymDwq3Cdx7Sz3tGpfOVd251uZevc3e9b2z367vvn/7/2e/73fe/v//+//fv/7r/59xv/fv/7786/Zft+++/X/++fv6////p9d3ets++v//XT9//t12t533+7/d3+et7==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4401
b: 11.4401
c: 11.4401
alpha: 90
beta: 90
gamma: 90
cell_volume: 1497.233
crystal_density: 3.577
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: sLsHAAAAAABg4xYA8P39/w==
atoms_y: wF0AAAAAAAAAAAAAyBYDAA==
atoms_z: AFUPAAAAAABAQg8AyFsJAA==
atoms_occupancy: QEIPAAAJPQAACT0AAAk9AA==
atoms_u_iso: QDgAAKAtAAAoKAAA2DsAAA==
atoms_aniso_label: ["Al", "Si", "O"]
atoms_aniso_u11: +A6yAKA7jQDwYd8A
atoms_aniso_u22: +A6yADi0pACg2QcB
atoms_aniso_u33: +A6yADi0pABQ4tYA
atoms_aniso_u12: YJ4BAAAAAADw3OL/
atoms_aniso_u13: YJ4BAAAAAABo5SoA
atoms_aniso_u23: YJ4BAAAAAADIVAsA
pub_title:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 96.7 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAEAABAAAAAAAAQACAAAAgAgBACAAAQBAAAAIBAIAAgICAgIEAAAgQIEECBABBAAhBBACCCEEIIAgCEIIQCEAAhEIhCARCAgAIiIBABEAAREBEAIAAEAAABAAAAAAAAASAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4425
b: 11.4425
c: 11.4425
alpha: 90
beta: 90
gamma: 90
cell_volume: 1498.176
crystal_density: 3.575
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAUP39/w==
atoms_y: AAAAAAAAAAAAAAAAgBMDAA==
atoms_z: QEIPAAAAAABAQg8AaFwJAA==
atoms_occupancy: 0
atoms_u_iso: YFQAAJgrAAC4KQAAoDwAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 122.3 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQACAAAAgAgBACAAAQBAAAAIBAIAAgICAgIEAAAgQIEECCABBABBBBACCCEEIQAgCEIIQCEAAiEIhCAREAgARCICABEAAREBEAIAAEAAABAAAAAAAAASAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4450
b: 11.4450
c: 11.4450
alpha: 90
beta: 90
gamma: 90
cell_volume: 1499.158
crystal_density: 3.572
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAsPz9/w==
atoms_y: AAAAAAAAAAAAAAAAiBUDAA==
atoms_z: QEIPAAAAAABAQg8AcF4JAA==
atoms_occupancy: 0
atoms_u_iso: cGcAAPgvAADILQAA8EEAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 173.7 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQACAAAAgBABACAAAQBAAAAIBAIAAgICAgIEAAAgQIEECCABBABBBBACCEEIIQAgCEIIgCEAAiEIhEAhEAgARCICABEAAREBEAIAAEAAABAAAAAAAAAiAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4508
b: 11.4508
c: 11.4508
alpha: 90
beta: 90
gamma: 90
cell_volume: 1501.438
crystal_density: 3.567
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYA6Pv9/w==
atoms_y: AAAAAAAAAAAAAAAACBMDAA==
atoms_z: QEIPAAAAAABAQg8ACF0JAA==
atoms_occupancy: 0
atoms_u_iso: aHkAAAA3AACIMQAAwEkAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 223.3 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQACAAABABABACAAAQCAAAAIBAIAAgICAgQEAAAgQIIECCABBABBBBACEEEIIQBACEIQgCEABCEQhEAhEAgAREICACIAAiICIAQAAIAAACAAAAAAAAAkAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4548
b: 11.4548
c: 11.4548
alpha: 90
beta: 90
gamma: 90
cell_volume: 1503.012
crystal_density: 3.563
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAKP39/w==
atoms_y: AAAAAAAAAAAAAAAAIBQDAA==
atoms_z: QEIPAAAAAABAQg8A4FwJAA==
atoms_occupancy: 0
atoms_u_iso: yIwAAFg+AAAgOgAAYFQAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 273.6 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABABACAAAgCAAAAIBAQAAgICAgQEAAAgQIIECCACBABBCCACEEIIQQBACEIQgCEABCEQiEAiEBAAhEQEACIAAiICIAQAAIAAACAAAAAAAABEAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4572
b: 11.4572
c: 11.4572
alpha: 90
beta: 90
gamma: 90
cell_volume: 1503.957
crystal_density: 3.561
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAEPz9/w==
atoms_y: AAAAAAAAAAAAAAAAYBADAA==
atoms_z: QEIPAAAAAABAQg8AQFwJAA==
atoms_occupancy: 0
atoms_u_iso: eJYAABBAAABgOwAAOFkAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 295 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABABACAAAgCAAAAIBAQAAgICAgQEAAAgQIIEECACBABBCCACEEIIQgBACEIQgCIABEIQiIBCIBAAhEQEACIAAiIEQAQAAIAAACAAAAAAAABEAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4592
b: 11.4592
c: 11.4592
alpha: 90
beta: 90
gamma: 90
cell_volume: 1504.745
crystal_density: 3.559
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAOPz9/w==
atoms_y: AAAAAAAAAAAAAAAAmA8DAA==
atoms_z: QEIPAAAAAABAQg8AgF0JAA==
atoms_occupancy: 0
atoms_u_iso: aKEAADhFAACwQAAAyF8AAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 322.8 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABABAEAAAgCAAAAIBAQAAgICBAQIAAAgQQIEEEACCACBCCACEEIIQgBACEIRACIABEIQiIBCIBAAhEQEACIAAiIEQAQAAQAAAEAAAAAAAABEAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4641
b: 11.4641
c: 11.4641
alpha: 90
beta: 90
gamma: 90
cell_volume: 1506.676
crystal_density: 3.554
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYA6Pv9/w==
atoms_y: AAAAAAAAAAAAAAAA0A4DAA==
atoms_z: QEIPAAAAAABAQg8AmF4JAA==
atoms_occupancy: 0
atoms_u_iso: MLYAAKBLAACwRQAAAGkAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 373.5 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABABAEAAAgCAAAAIBAQAAgIEBAQIAAAggQIEEEACCACCCCAEEEIIQgBAEIQhAEIACEIhCIBCIBAAiEgEAEQABEQEQAQAAQAAAEAAAAAAAABEAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4690
b: 11.4690
c: 11.4690
alpha: 90
beta: 90
gamma: 90
cell_volume: 1508.609
crystal_density: 3.550
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYA+Pr9/w==
atoms_y: AAAAAAAAAAAAAAAAEBADAA==
atoms_z: QEIPAAAAAABAQg8AGGEJAA==
atoms_occupancy: 0
atoms_u_iso: CMoAAGhWAACITwAAGHQAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 423.3 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABACAEAAAgCAAAAICAQABAQEBAQIAABAgQIIEEACCACCCCAEEIIQQgBAEIQhAEIACEIhEIBEIBAAiIgEAEQABEQEQAgAAQAAAIAAAAAAAABIAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4730
b: 11.4730
c: 11.4730
alpha: 90
beta: 90
gamma: 90
cell_volume: 1510.188
crystal_density: 3.546
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYA+Pr9/w==
atoms_y: AAAAAAAAAAAAAAAAGA0DAA==
atoms_z: QEIPAAAAAABAQg8AYF8JAA==
atoms_occupancy: 0
atoms_u_iso: 6N8AAFhcAAAAVQAAgH8AAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 472.6 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABACAEAAAgCAAAAQCAQABAQEBAgIAABAgQIIEEACCACCCCAEEIIQQgCAEIQhAEIACEQhEIBEICABEIgIAEQABEQEQAgAAQAAAIAAAAAAAABIAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4801
b: 11.4801
c: 11.4801
alpha: 90
beta: 90
gamma: 90
cell_volume: 1512.993
crystal_density: 3.540
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAWPr9/w==
atoms_y: AAAAAAAAAAAAAAAAOAsDAA==
atoms_z: QEIPAAAAAABAQg8AqF0JAA==
atoms_occupancy: 0
atoms_u_iso: mO4AAHBiAADAWAAAoIcAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 523.0 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABACAEAAAgCAAAAQCAQABAQEBAgQAABAgQQIIEAEEACEEEAIIIQQggCAIQQhAIQACIQiEQCEQCABEQgIAIgACIgIgAgAAQAAAIAAAAAAAACQAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4848
b: 11.4848
c: 11.4848
alpha: 90
beta: 90
gamma: 90
cell_volume: 1514.852
crystal_density: 3.535
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAuPn9/w==
atoms_y: AAAAAAAAAAAAAAAAcAoDAA==
atoms_z: QEIPAAAAAABAQg8AiF8JAA==
atoms_occupancy: 0
atoms_u_iso: 4AABADhoAADwXwAAsJAAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 572.9 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABABACAEAAAgCAAAAQCAgABAQEBAgQAABBAQQIIEAEEACEEEAIIQQghACAIQhCAIQAEIRCEQCEQEABERAQAIgACIgIgBAAAgAAAIAAAAAAAAEQAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4893
b: 11.4893
c: 11.4893
alpha: 90
beta: 90
gamma: 90
cell_volume: 1516.634
crystal_density: 3.531
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAuPn9/w==
atoms_y: AAAAAAAAAAAAAAAA8AcDAA==
atoms_z: QEIPAAAAAABAQg8A2F8JAA==
atoms_occupancy: 0
atoms_u_iso: GBQBACBxAADgZQAA8JsAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 622.9 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAQAEAAABACACAEAAAgEAAAAQCAgABAQECAgQAACBAgQQIIAEEAEEEEAIIQQghAEAIQhCAIQAEIRCIQCIQEACERAQAIgACIgJABAAAgAAAIAAAAAAAAEgAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.4960
b: 11.4960
c: 11.4960
alpha: 90
beta: 90
gamma: 90
cell_volume: 1519.289
crystal_density: 3.525
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAMPr9/w==
atoms_y: AAAAAAAAAAAAAAAAQAgDAA==
atoms_z: QEIPAAAAAABAQg8AYF8JAA==
atoms_occupancy: 0
atoms_u_iso: kCgBAMh4AACoawAAgKcAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 672.9 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAABAAAAAAAAgAEAAACACACAEAABAEAAAAQCAgABAQECAgQAACBAgQQIIAEEAEEEIAIIQghBAEAIQhCAIgAEQhEIQCIgEACISAQARAACRARACAABAAAAQAAAAAAAAIgAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.5023
b: 11.5023
c: 11.5023
alpha: 90
beta: 90
gamma: 90
cell_volume: 1521.788
crystal_density: 3.519
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAyPj9/w==
atoms_y: AAAAAAAAAAAAAAAASAUDAA==
atoms_z: QEIPAAAAAABAQg8AiF8JAA==
atoms_occupancy: 0
atoms_u_iso: kEEBAOiAAADYcgAAKLQAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 723.0 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAACAAAAAAAAgAEAAACACACAEAABAEAAAAQCAgABAQICAgQAACBAggQIIAIEAEEIIAIQQghCAEAQhCCAQgAIQiEQgEQgEACIiAQARAAERARACAABAAAAgAAAAAAAAJAAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.5078
b: 11.5078
c: 11.5078
alpha: 90
beta: 90
gamma: 90
cell_volume: 1523.972
crystal_density: 3.514
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAGPn9/w==
atoms_y: AAAAAAAAAAAAAAAA+AQDAA==
atoms_z: QEIPAAAAAABAQg8AeGAJAA==
atoms_occupancy: 0
atoms_u_iso: UFQBAFiJAADoewAAeL4AAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 773.1 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAACAAAAAAAAgAIAAACACACAIAABAEAAAAQEAgACAgICBAQAACBAggQQIAIIAIIIIAQQQghCAEAQhCEAQgAIRCEQgEQgIAEIiAgAhAAERAiACAACAAAAgAAAAAAAAJAAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.5136
b: 11.5136
c: 11.5136
alpha: 90
beta: 90
gamma: 90
cell_volume: 1526.277
crystal_density: 3.509
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAsPf9/w==
atoms_y: AAAAAAAAAAAAAAAAyP0CAA==
atoms_z: QEIPAAAAAABAQg8AMGIJAA==
atoms_occupancy: 0
atoms_u_iso: IGYBAKCRAACgfQAA8MgAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 823.1 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAACAAAAAAAAgAIAAACACAEAIAABAEAAAAgEAgACAgICBAgAACBBAgQQIAIIAIIIIAQQghBCAIAQhCEAggAIhCIRAIRAIAERCAgAiAAIiAiAEAACAAABAAAAAAAAAJAAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.5195
b: 11.5195
c: 11.5195
alpha: 90
beta: 90
gamma: 90
cell_volume: 1528.625
crystal_density: 3.503
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAePj9/w==
atoms_y: AAAAAAAAAAAAAAAA8AIDAA==
atoms_z: QEIPAAAAAABAQg8A2F8JAA==
atoms_occupancy: 0
atoms_u_iso: +HkBALCaAAAwiQAAONYAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 873.1 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAACAAAAAAAAgAIAAACACAEAIAABAEAAAAgEAgACAgIEBAgAAECBAggQQAIIAIIIIAQghBCCAIAhBCIAhAAQhEIRAIRAIAIREAgAiAAIiAkAEAACAAABAAAAAAAAASAAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.5244
b: 11.5244
c: 11.5244
alpha: 90
beta: 90
gamma: 90
cell_volume: 1530.576
crystal_density: 3.499
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAAPj9/w==
atoms_y: AAAAAAAAAAAAAAAAsAEDAA==
atoms_z: QEIPAAAAAABAQg8A8GAJAA==
atoms_occupancy: 0
atoms_u_iso: cIkBANCiAADgkgAAiOAAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 922.9 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAIAACAAAAAAAAgAIAAACACAEAIAABAIAAAAgEBAACAgIEBAgAAECBAgggQAIQAIQQQAQghBCEAIAhCEIAhAAQhEIhAIhAQAIhEBAAiAAJEBEAIAACAAABAAAAAAAAASAAAAAAAAAAAAAAAAAA==


formula: Mg3 Al2 Si3 O12
compound: Synthetic
formula_title: <missing>
a: 11.5291
b: 11.5291
c: 11.5291
alpha: 90
beta: 90
gamma: 90
cell_volume: 1532.450
crystal_density: 3.495
atoms_sites: ["Mg", "Al", "Si", "O"]
atoms_x: IKEHAAAAAABg4xYAyPj9/w==
atoms_y: AAAAAAAAAAAAAAAAsAEDAA==
atoms_z: QEIPAAAAAABAQg8A8GAJAA==
atoms_occupancy: 0
atoms_u_iso: eJoBAEioAADomQAAEOoAAA==
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:
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 972.9 K

qdat:
AAAAAAAAAAAAAAAAAAAAAAQAACAAAAAAAAgAIAAACACAEAIAACAIAAAAgEBAACAgQECAgAAECBBAggQAQQAIQQQAQhBCCEAQAhCEIAiAAQiEIhAIiAQAIiEBABEAAREBEAIAAEAAABAAAAAAAAAkAAAAAAAAAAAAAAAAAA==


formula: K1.26 Na2.22 Ta9.11 Nb1.29 Al.6 O31
compound: Urubu pegmatite, Itinga, Minas Gerais, Brazil
formula_title: <missing>
a: 17.224
b: 17.687
c: 3.9361
alpha: 90
beta: 90
gamma: 90
cell_volume: 1199.097
crystal_density: 6.594
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:
 Rankamaite from the Urubu pegmatite, Itinga, Minas Gerais,
 Brazil: Crystal chemistry and Rietveld refinement
 Note: Identification of OH not reported

atoms_sites:
["K1", "Na2", "Na3", "Ta1", "Nb1", "Ta2", "Nb2", "Ta3", "Al3", "Ta4", "Nb4", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10"]

atoms_x:
IMsyAOB0HgBAQg8AAAAAAAAAAAAAAAAAAAAAAEgCCwBIAgsAcNQGAHDUBgCwvhMA0KAlAABmCADwVgQAYAcRAHC7BgAAAAAAAAAAAEBiKwAAAAAA

atoms_y:
AAAAAAAAAABAQg8AAAAAAAAAAAAgAikAIAIpADANGAAwDRgAqC8yAKgvMgDQeQYAEF0pALDKEQBARyMAkJwUACChOQBgWRQAMEYMAAAAAAAAAAAA

atoms_z:
gIQeAICEHgCAhB4AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAhB4AgIQeAAAAAAAAAAAAAAAAAAAAAACAhB4AAAAAAAAAAACAhB4A

atoms_occupancy:
wHMmAMA+GgAAgSkAwFUrAECzEQAA8isAABcRAEDhMwDAJwkAQFI2AMC2BgAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
eHoDAHh6AwB4egMAyIsBAMiLAQDIiwEAyIsBAMiLAQDIiwEAyIsBAMiLAQD4xQAA+MUAAPjFAAD4xQAA+MUAAPjFAAD4xQAA+MUAAPjFAAD4xQAA

qdat:
AAAAAAAAEAABQAAAAgBQAAACIECggQQkFAhWlGoAJBE1YYyIDC3pEbenOFc/dc4dlXpL2NEQpysNOkIDvXwNRKP9cgbBReSw0iIO6wIgBpFSw3Hi1QNik045IhrQRAaSAAA4AqYbmXIFlSWWon3CQOUAANAAABAD3PGdw9==


formula: (Al1.04 W.96) O6 H3.2
compound: Mt Misobo Mine, Democratic Republic of the Congo
pub_title: A new type of cubic-stacked layer structure in anthoinite, AlWO3(OH)3
formula_title: <missing>
a: 8.196
b: 9.187
c: 11.316
alpha: 92.82
beta: 94.08
gamma: 90.23
cell_volume: 848.844
crystal_density: 4.754
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:
["Al1", "W1", "W2", "Al2", "Al3", "W3", "W4", "Al4", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "H1", "H2A", "H2B", "H3", "H4", "H5A", "H5B", "H5C", "H6", "H7"]

atoms_x:
YFMuAGBTLgBQ6QIAUOkCAEB3GwBAdxsAgLIOAICyDgBg1i0AwIwNAKC/NgAAXhoA4NkiAICiGQCgcxkAYFQZAGDdFwDgkhkAoJ0SAGBZLQAggwwAAOEZAGBUGQBglg4AgMo8AKAgEgBgARIAgOoNAOAKBgCA7jYA

atoms_y:
wFgeAMBYHgAwGw8AMBsPAMCADwDAgA8AsF0fALBdHwCgJSYA4IcGAOB5MgAgjwoAAFkGAEA1JgDAeSUAwBM2AOCqFQBgMQoAgNY6AGDXGABgWwMAQDwQAKAOFQDgmQMAoHMZACB7NwAAjDwAQPkvACBlEQDgkhkA

atoms_z:
cAU1AHAFNQBgCC4AYAguAKA4DgCgOA4AAHomAAB6JgDgJisAgDYrAMACJACA7jYAgHkLAAD+KQAANQwA4LYTAEA7JQAguBgAYKcgACCOHwCgnCcAwNQBAEAZAQCAAgoAIHAkAMA/BQDASwMAQB8AAOClAQBgbQAA

atoms_occupancy:
IM8pAOA5EwCAuSoAgE8SAOBnNQAgoQcAgJsvAIBtDQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQCAKi0AwOQoAEAkFAAACT0AAAk9AEBZIADArxwAQFkgAMBzJgCAhB4A

atoms_u_iso:
cLEBAHCxAQBwsQEAcLEBAHCxAQBwsQEAcLEBAHCxAQCwjwEAsI8BALCPAQCwjwEAsI8BALCPAQCwjwEAsI8BALCPAQCwjwEAsI8BALCPAQD4uwAA+LsAAPi7AAD4uwAA+LsAAPi7AAD4uwAA+LsAAPi7AAD4uwAA

qdat:
AAAAAAAAAIAIBAAgIQEAIAJIAiIBUAaECI0hHQEWUQpBHSW2cgzTXozaa1qj7det353Y33sv55d7fnp3/7eq+3/7r/96/f+/+83+v9/9/+/3///v/7/99+/v/vb/f//7/3/v/u/bv7q+///6/n27/6/33587ePuzuu3Evf==


formula: Fe8 Si6 O23.584 Cl1.857 H12.025
compound: Burguillos del Cerro, Badajos, Spain
pub_title: Pyrosmalite-(Fe), Fe8Si6O15(OH,Cl)10 Note: sample rruff.info/R050158
formula_title: <missing>
a: 13.3165
b: 13.3165
c: 7.0845
alpha: 90
beta: 90
gamma: 120
cell_volume: 1087.978
crystal_density: 3.268
atoms_x: AAAAAPCRDwCAhB4ASK0eAICrGgAI1BQASGgiALBJGgDgnBkAMFcKAHANCgCgbhQAeH0jAFVYFABwcAYAwGIUACB2IwBVWBQA
atoms_y: AAAAAAAAAAAAAAAAuFYPAMhZBgAAAAAAkMcHANgkDQA4DgUAmCsFAIAHBQBQNwoAGPIJAKuwKABwcAYA8DIKAEDjCQCrsCgA
atoms_z: AAAAAAAAAAAAAAAAkDIBAJhBJgCAhB4AoD0iAMAOIgC43DMAUD8vAJCeNQCg+AcAsM4IAHC1BwCAhB4AYJAPAAAdEABgihAA
atoms_occupancy: AAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A4MclACBBFwAACT0AAAk9AAAJPQDg+AgAAAk9AAAJPQAACT0A
atoms_u_iso: uPEAAGi6AADgnAAA6JQAAFBpAADgxAAAkLAAAKC+AABAnAAAUCcBANDPAACQyQAAoKUAAHCtAAAgNgQAwNQBAMDUAQDA1AEA
atoms_aniso_label: ["Fe1", "Fe2", "Fe3", "Fe4", "Si1", "O1", "O2", "O3", "O4", "Cl1", "O-H1", "O-h2", "O-h3", "O-h4"]
atoms_aniso_u11: YLgAAGicAACIiwAAuHQAALBoAADQnQAAEIsAAAATAQAQpAAAEO8AAEAZAQAAyAAAILIAAFCqAAA=
atoms_aniso_u22: YLgAAKiEAAAQiwAAWHoAAIBXAAAgmQAAIOQAAOCSAABAtQAAsDABANDPAAAgywAAcMYAAFCqAAA=
atoms_aniso_u33: 0GUBAFgGAQAwwAAA8M0AAKh/AAAgFgEAoL4AAMDBAABAgwAAUEABAECcAAAgywAAIIAAANC2AAA=
atoms_aniso_u12: CFwAAEBCAABgRQAASDoAAMgyAACQTAAAEHIAAICJAADAXQAAwHYAAKCMAAAAZAAAcGIAAGBUAAA=
atoms_aniso_u13: AAAAALAOAADwCgAAKAUAACj7//9A1P//IAMAAJDo//9ABgAAUPv//7Dr///gLgAAYAkAAAAAAAA=
atoms_aniso_u23: AAAAAGAdAAAIFgAAgAIAAKj4//+AqP//0AcAAIDz//9QFAAAgP3//xD1//9wFwAAUBQAAAAAAAA=
atoms_sites:
["Fe1", "Fe2", "Fe3", "Fe4", "Si1", "O1", "O2", "O3", "O4", "Cl1", "O-H1", "O-h2", "O-h3", "O-h4", "Wat", "H1", "H2", "H3"]

qdat:
AAAAAAAAAgAAAABCAIQAAEAEgAAQQEAkCEDAoAQUQCIQYIBxgMMgiAcSOYGVBZilicE8EMRRuFeDRnnwvjoznQvHbcfF969nx85L1w6ffvV6/WduVvuXg53r3+PCyt/60d9Rvv/dizFvb/uSimz7//J85v33ZtqfvjDZmM==


formula: Ca4 As3 O16 H9
compound: Corbriza mine, Copiapo, Chile
formula_title: <missing>
a: 5.8220
b: 10.1750
c: 22.8816
alpha: 90
beta: 96.902
gamma: 90
cell_volume: 1345.657
crystal_density: 3.209
atoms_occupancy: 0
pub_title:
 The crystal structure of vladimirite, with a revised chemical formula,
 Ca4(AsO4)2(AsO3OH)*4H2O
 Note: Sample R080001

atoms_sites:
["Ca1", "Ca2", "Ca3", "Ca4", "As1", "As2", "As3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12H", "OW1", "OW2", "OW3", "OW4", "H1", "H2", "H3", "H4", "H5", "H6", "H7", "H8", "H9"]

atoms_x:
gPIoAKhSAABwQDYASHUaAFgENQDoACEAiBQOABBINACgFggAeCIpAFBcMADILyEA8DYQAAiOKACwnCsAoLcqALDMAAB4AwwAyMkdACBmAQAQaA8A2PMuAPAeKAAY3fv/iNwEAECADQCA7hMAkKEtALCINQCIeSsAmDQkALDDIgA=

atoms_y:
AFEsANAANACQmBMAiDkWAIB3IQBAFQAASLIjALiUKwBYVx4AeFsdALAEHgCYCAoA2AE6AJiuOwDo1TcAWIsXAOgqKQBw+BkAyAYnAFBWCQDQ5Q0A2PENAFABDgBg+wgAUL8EAFCDCQAAnQ0AMEQJADhaDgBgYwoAEPwMAMgBIgA=

atoms_z:
wCYAAFiaCADIhgYAiPoOAMAPDQDw6wUAKAcDAFj6DABwUQwAGNQJALD4EAAQ/wQA2EUFAKg5CgCYkQMAUBgBAPg/BABg0wMAuGoFAHiPAgBg8AkASB8MALg+EwAwHwEAKH8DAOjGCgDAqggAIJ0LAACYDQCorhIAcOQUAHB+BwA=

atoms_u_iso:
iIsAAOiKAAAorwAAgJ0AAOhxAABodAAA4G8AANifAABo2AAA+N4AAEiyAAC4lwAAgMUAALi1AAAwuwAASMYAALC4AABIvAAAEJAAAFDSAAAAzQAAuN0AAIDAAADA1AEAwNQBAMDUAQDA1AEAwNQBAMDUAQDA1AEAwNQBAMDUAQA=

atoms_aniso_label:
["Ca1", "Ca2", "Ca3", "Ca4", "As1", "As2", "As3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12H", "OW1", "OW2", "OW3", "OW4"]

atoms_aniso_u11:
MGYAANBrAAD4mAAAyG4AAHhfAABIWAAAoFAAANiVAAAobgAAgMoAAEioAABYdQAACCoAAMCUAADogAAAoJsAAIiBAAC42AAAICYAADiQAABA3QAAcO4AAEC1AAA=

atoms_aniso_u22:
8KUAAJCXAABw2gAAaKsAAOhxAADodgAAcHsAAGB3AACg6wAAoKoAANDKAABoeQAAGAABADjgAABo2AAAEDoBAEjQAABoZQAAKMMAADDUAAA4xwAAUL4AAMjSAAA=

atoms_aniso_u33:
eJYAAGicAADongAAmLcAAGCBAAAIjgAAKIIAAMDVAADYOgEAEAMBAJCwAAAA1wAAwCABACCjAACg3AAAAH0AAJjaAAC4BQEAiLgAAAgLAQC4zgAAqNkAANDAAAA=

atoms_aniso_u12:
2P///8AIAACYKwAAAAoAAJAGAABACwAACAIAALAJAADAUwAA8AoAABDw//9gCQAA+N///0AVAACoOQAAWP3//4gxAADI7P//eOL//wgHAACoBwAAiPr//yANAAA=

atoms_aniso_u13:
GBAAADAMAACIJwAAmPT//0ABAACwDgAAqAcAAGgkAACASAAAgIX//1hIAABIDQAA8Pv//+Dt//9gJwAA4BAAAPAeAACwWQAAENL//5j5//+QTAAAyM7//6g0AAA=

atoms_aniso_u23:
kO3//0AQAABAKQAAsP////AFAADwCgAAeAAAALATAAA4OwAAmOX//4AlAAAAHgAAUDIAAMgZAADowv//0CAAAMjO//+AAgAAqAwAAKgCAAAg+f//+AwAALgaAAA=

qdat:
AAAAAAAAAQAIABAAAQUADZECBQQOQWBSSBVB5WMRUWeny0caYOFGOovu7SfVqR/5fN5+X7lq/59716fu+/vet/bWvM/7f3u/P37+9n79//+v+/3/X38////q7+P27rNXOfv3/+j7738/V+tY7rq77z7e/b075v37Ljf5v3==


formula: Ca4 As3 O16 H9
compound: Ait Ahmane vein No. 53, Bou Azzer district, Morroco
formula_title: <missing>
a: 5.8279
b: 10.1802
c: 22.8944
alpha: 90
beta: 96.943
gamma: 90
cell_volume: 1348.345
crystal_density: 3.203
atoms_occupancy: 0
pub_title:
 The crystal structure of vladimirite, with a revised chemical formula,
 Ca4(AsO4)2(AsO3OH)*4H2O
 Note: Sample R100075

atoms_sites:
["Ca1", "Ca2", "Ca3", "Ca4", "As1", "As2", "As3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12H", "OW1", "OW2", "OW3", "OW4", "H1", "H2", "H3", "H4", "H5", "H6", "H7", "H8", "H9"]

atoms_x:
WPIoAAhSAADIQjYAKHcaAHgCNQBwACEAUBUOANhDNABIDwgAMB8pAMhSMAB4OSEAyCwQADiLKACAnysAkLgqAGjOAABI/AsAWNAdAChoAQAIaw8AiPguAAAoKACgqvv/KPsEANgeDgAozRQA0CotACAPNQAQLisAIOgkAAChIgA=

atoms_y:
6E8sANAANAD4mRMAODkWAAh3IQAAFAAAcLIjAMCRKwD4Vx4ACF0dAAAFHgDQBwoACP85ANCtOwA41jcAIIwXAIgrKQBA9hkAkAwnABhhCQCQ5A0A0O8NAGgCDgDgZwgAePYEANhpCQAgZA0AmOsIALBLDgDYoAkAKNUMAIj6IgA=

atoms_z:
ECcAADCaCADwhgYA6PkOAOgPDQDw6wUAYAYDAOj7DADwTgwAkNQJAGD4EABg/wQAgEMFALg4CgBYkAMACBoBAFg/BABg0wMAIGwFADiOAgD47gkA6B8MAFA9EwBwKgEA8EgDACjcCgBIcwgAyKQLAPiBDQA4xBIAIN8UACA4BwA=

atoms_u_iso:
GI0AALiIAACgrwAA0J0AAABuAACIcgAAMHAAAHiWAAAQ2wAAmOQAAOi8AABAoQAAwNAAAKi2AABYuwAAoMgAAHCyAAAgrQAAIJ4AACDaAABwxgAAwNoAAMi5AADA1AEAwNQBAMDUAQDA1AEAwNQBAMDUAQDA1AEAwNQBAMDUAQA=

atoms_aniso_label:
["Ca1", "Ca2", "Ca3", "Ca4", "As1", "As2", "As3", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12H", "OW1", "OW2", "OW3", "OW4"]

atoms_aniso_u11:
0IkAAKCCAAAIuwAAOJUAADh3AADwbgAA6GwAACCyAACIuAAAyBgBAEjpAAD4wAAAmHsAAEjVAAA4wgAAQLAAACCFAAAw3gAAiIEAANC2AACo6AAAMPcAACi+AAA=

atoms_aniso_u22:
8JYAAJiKAADYxwAAAJYAAABfAACwaAAA2G0AADBmAACI2wAAGJwAAIC2AADwbgAAqOMAALC9AACArAAAKDsBAMi+AADYWQAAgLEAAIifAABIwQAAqMoAAMC3AAA=

atoms_aniso_u33:
AIcAAJCNAACQkgAAgKcAAOhxAAA4gQAAIHYAAKCvAAD4CwEAWNkAAAiiAADgsAAAcBEBAFCMAACoygAAGG8AAFDNAABg2wAAGJwAAJg0AQDItAAAEL0AAMi+AAA=

atoms_aniso_u12:
8AAAAKgHAACQKQAAMAcAAMAIAAAQCQAAWAIAACgFAADoWAAAqAIAAODy//9gCQAAmNb//4AbAADgJAAAOAQAAAAtAACg7P//6P7//5gXAADoEgAAqOn//0gNAAA=

atoms_aniso_u13:
iBMAAHASAACALwAAuPf//1gHAAB4FAAAUA8AAJgmAAAwVwAAuJ3//5hEAADYCQAAMBEAAOABAAAgNQAAoBQAAKD7///wSwAACOT///APAAAYRwAA8NP///g0AAA=

atoms_aniso_u23:
cO///2ATAAD4JQAAyPv//5AGAACICQAAyAAAADAHAABYOQAA4PL//zAgAADIGQAAOEAAAEgwAABgw///WCUAAGDX//+A8///YBgAAEgXAADoAwAASAMAANAWAAA=

qdat:
AAAAAAAAAQAIABAAAQUAF5ECBQQKQWBSSBVB5WcRUeery4ce4eGGcpPe9StdqT/ZfJyuX3lN7b9712fc+///9/bUvJ36/vv+f/9v9nvp+/tfu/3//14//93r78Pk7vXXcv7t+9H2/v52r++53ffv3Xv8+/szZWnVfC97ff==


formula: U S2 O12 H8
compound: Jachymov, Czech Republic
formula_title: <missing>
a: 14.6464
b: 11.0786
c: 5.6910
alpha: 90
beta: 90
gamma: 90
cell_volume: 923.431
crystal_density: 3.612
atoms_sites: ["U", "S", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "H1", "H2", "H3", "H5"]
atoms_x: 4JcyAMDtMwAAkjsAwGs4ALDMMgAQVDcAMHQuANCeNgAQ7SoAIMkqAACqNwCgoTsAIFc9AA==
atoms_y: wMYtALAqGwDAxi0A8CAmAFAjIwAQOhoAcG4XAAA4GADAxi0AABcqAACrIgCATicAwBAqAA==
atoms_z: yK0HAACJFwCAzBIAAL0GAAB8FQDwRSQA0GsZAPCvCgBQaxcA4IAcAGAlDABA7wcA4C0VAA==
atoms_occupancy: 0
atoms_u_iso: AJYAAOCSAACAOAEAIEgBAOAoAQCgCQEAQBkBAOAoAQAgSAEAAIsBALCKAQCwigEAEHEBAA==
atoms_aniso_label: ["U", "S", "O1", "O2", "O3", "O4", "O5", "O6", "O7"]
atoms_aniso_u11: 0J0AAAB9AADA2gAAgLsAAKCGAQDAVwEAwNoAAMDaAADAVwEA
atoms_aniso_u22: MHUAAGBtAADgqwAAQBkBAECcAABAnAAAgDgBACBIAQBg6gAA
atoms_aniso_u33: cK0AAEDOAABAEwIAoAMCACBIAQDgKAEA4CgBAGBnAQBAlgEA
atoms_aniso_u12: AAAAALAEAAAAAAAA4C4AALAdAABgIgAAQJwAAKAoAAAAAAAA
atoms_aniso_u13: yAUAAIAMAABg6gAAMFwAADARAADgkgAAMFwAAKCMAABAGQEA
atoms_aniso_u23: AAAAAJABAAAAAAAAkMkAACADAACgDwAAsDYAAACvAAAAAAAA
pub_title:
 Behounekite, U(SO4)2(H2O)4, From Jachymov (St Joachimsthal), Czech Republic:
 the first natural U4+ sulphate

qdat:
AAAAAAAAAAAAAAIAAQBCCBAKAQAIKBwBABsIDFDE+IjDMAD+CYLcTIWym53S5K1/Arcuum127n+3/5z9/zr25+f/3v5qt//8v/be/v+udf2PO++////bvt3t6zuVev09V/ut/rvvzZWnV5ZTp97b3e73yPX/yt2x62/Wnf==


formula: Ca3.48 Sm.04 Nd.24 Pr.06 Ce.5 La.18 Y.1 (Ti.64 Nb.33 Zr.03) Na2.28 Si4 O15.4 F2.6
compound: Kangerdluarssuk, Ilimaussaq, Greenland
formula_title: <missing>
a: 7.4328
b: 5.6595
c: 18.8181
alpha: 90
beta: 101.353
gamma: 90
cell_volume: 776.112
crystal_density: 3.496
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:
 From structure topology to chemical composition. XII. Titanium silicates:
 the crystal chemistry of rinkite, Na2Ca4REETi(Si2O7)2OF3
 Note: sample 1991c

atoms_sites:
["CaMH", "SmMH", "NdMH", "PrMH", "CeMH", "LaMH", "YMH", "CaAP", "SmAP", "NdAP", "PrAP", "CeAP", "LaAP", "YAP", "TiMO(1)", "NbMO(1)", "ZrMO(1)", "NaMO(2)", "NaMO(3)", "CaMO(3)", "Si(1)", "Si(2)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "OXOM", "FXOM", "FXOA"]

atoms_x:
uLoFALi6BQC4ugUAuLoFALi6BQC4ugUAuLoFANhsJADYbCQA2GwkANhsJADYbCQA2GwkANhsJAAAAAAAAAAAAAAAAACAhB4AkNMtAJDTLQCYaxUAuNYvACAyDQCwzDIAgKcUANB+MwCAdRQAoBw0APAGIgCg6gEAoOoBAABsIAA=

atoms_y:
0EMoANBDKADQQygA0EMoANBDKADQQygA0EMoANB1KADQdSgA0HUoANB1KADQdSgA0HUoANB1KAAAAAAAAAAAAAAAAAAAAAAA6JQeAOiUHgCobAkAKGAJACAxCQBgoQgAICIYAOA0GACwwTgA8OA4AECeCADQ5ioA0OYqAMAcKAA=

atoms_z:
4LQLAOC0CwDgtAsA4LQLAOC0CwDgtAsA4LQLAEidCwBInQsASJ0LAEidCwBInQsASJ0LAEidCwAAAAAAAAAAAAAAAAAAAAAAOAkAADgJAAAYjwgAcGkIAJDBAwDgigMAyEoLABADCwBAqgsAAJULAHhdBwAwwgMAMMIDAFjlAwA=

atoms_occupancy:
gLkqAECcAADARQQAgDgBAICLCABADQMAwNQBAABjLgBAnAAAQA0DAECcAADAtgYAAHECAIA4AQAAECcAQCQUAMDUAQAACT0AABAnAAAXEQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQCAuSoAgE8SAAAJPQA=

atoms_u_iso:
eOYAAHjmAAB45gAAeOYAAHjmAAB45gAAeOYAAKD1AACg9QAAoPUAAKD1AACg9QAAoPUAAKD1AACQeAEAkHgBAJB4AQBwQwEAoAMCAKADAgBg0QAA0M8AAJB4AQDAcAEAEFMBAGCAAQCwMAEAkC0BAJDcAQDgpQEA4KUBAND7AQA=

qdat:
AAAAAAAAAAAIAAIAAAAIgCCEBQAQCYEABB0EAlDmmAgXoIDROkcBmEcDHP+mqSPcsxzRckM/MZ7tm7rdl36F9O9Oe1b7L7y33rfonTv2/ufe+rT79vP93f52t155b7V/37+v/qs+33b+37/W9+eN/7z67q///t/zz7z92X==


compound: Ilimaussaq, Greenland
formula_title: <missing>
a: 7.4414
b: 5.6628
c: 18.8315
alpha: 90
beta: 101.383
gamma: 90
cell_volume: 777.934
crystal_density: 3.520
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
formula:
Ca3.44 Gd.04 Sm.04 Nd.24 Pr.06 Ce.5 La.16 Y.08 Sr.02 (Ti.6 Nb.34 Zr.06) Na2.3 Fe.02 Mn.02 Si4 O15.04 F2.96

pub_title:
 From structure topology to chemical composition. XII. Titanium silicates:
 the crystal chemistry of rinkite, Na2Ca4REETi(Si2O7)2OF3
 Note: sample 2909

atoms_sites:
["CaMH", "GdMH", "SmMH", "NdMH", "PrMH", "CeMH", "LaMH", "YMH", "CaAP", "SrAP", "GdAP", "SmAP", "NdAP", "PrAP", "CeAP", "LaAP", "YAP", "TiMO(1)", "NbMO(1)", "ZrMO(1)", "NaMO(2)", "NaMO(3)", "CaMO(3)", "FeMO(3)", "MnMO(3)", "Si(1)", "Si(2)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "OXOM", "FXOM", "FXOA"]

atoms_x:
YLgFAGC4BQBguAUAYLgFAGC4BQBguAUAYLgFAGC4BQAIaiQACGokAAhqJAAIaiQACGokAAhqJAAIaiQACGokAAhqJAAAAAAAAAAAAAAAAACAhB4A+NQtAPjULQD41C0A+NQtAPBjFQAo2i8A4EQNAFDDMgDgsBQAoIYzAPBzFACgHDQAoAsiAHDZAQBw2QEAUE4gAA==

atoms_y:
OEooADhKKAA4SigAOEooADhKKAA4SigAOEooADhKKACgfSgAoH0oAKB9KACgfSgAoH0oAKB9KACgfSgAoH0oAKB9KAAAAAAAAAAAAAAAAAAAAAAAcJQeAHCUHgBwlB4AcJQeABh1CQCQZgkAsDIJAACYCADwKRgAYEEYAMDPOADw4DgAYKEIALDjKgCw4yoAkCQoAA==

atoms_z:
QLQLAEC0CwBAtAsAQLQLAEC0CwBAtAsAQLQLAEC0CwA4ngsAOJ4LADieCwA4ngsAOJ4LADieCwA4ngsAOJ4LADieCwAAAAAAAAAAAAAAAAAAAAAASAgAAEgIAABICAAASAgAAOCPCABgaggAkMEDAPCJAwBQSgsAIAILAOinCwAIlwsAoF0HAPjCAwD4wgMAYOIDAA==

atoms_occupancy:
QB0qAECcAABAnAAAwEUEAIA4AQDAJwkAQA0DAIA4AQAAYy4AQJwAAECcAABAnAAAQA0DAECcAACAGgYAwNQBAIA4AQAAnyQAgMAUAICpAwAACT0AQKwnAMB6EABAnAAAQJwAAAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAC9HwAATB0AAAk9AA==

atoms_u_iso:
wOkAAMDpAADA6QAAwOkAAMDpAADA6QAAwOkAAMDpAAB4+gAAePoAAHj6AAB4+gAAePoAAHj6AAB4+gAAePoAAHj6AABQcgEAUHIBAFByAQCQLQEAkA4CAJAOAgCQDgIAkA4CACDkAAAQ1gAA8IEBANCXAQCwYgEAcI4BAOBBAQDgQQEAAPQBAMC7AQDAuwEAwAYCAA==

qdat:
AAAAAAAAAAAIAAIAAAAIgCCICQAQCYEABB0EAqDGmAgroIDRWkYCmEsDHP+muSO00zzSckVeMpzNKrVdn36F1K9W8pWzX+33n7W5Pl3tt6tc9tz99fP96tzvLdTbbr/v+1+/f/d9n3f/37+278+b//31rd++9//3X3X/mv==


compound: Yuskpor Mt., Khibiny, Kola, Russia
formula_title: <missing>
a: 7.4263
b: 5.6774
c: 18.8261
alpha: 90
beta: 101.390
gamma: 90
cell_volume: 778.115
crystal_density: 3.497
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
formula:
Ca3.58 Dy.02 Gd.02 Sm.04 Nd.18 Pr.06 Ce.46 La.18 Y.12 Sr.14 Ba.02 (Ti.85 Nb.12 Zr.03) Na2.2 Si4 O15.18 F2.82

pub_title:
 From structure topology to chemical composition. XII. Titanium silicates:
 the crystal chemistry of rinkite, Na2Ca4REETi(Si2O7)2OF3
 Note: sample YuksFe

atoms_sites:
["CaMH", "DyMH", "GdMH", "SmMH", "NdMH", "PrMH", "CeMH", "LaMH", "YMH", "CaAP", "SrAP", "BaAP", "SmAP", "NdAP", "PrAP", "CeAP", "LaAP", "YAP", "TiMO(1)", "NbMO(1)", "ZrMO(1)", "NaMO(2)", "NaMO(3)", "CaMO(3)", "Si(1)", "Si(2)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "OXOM", "FXOM", "FXOA"]

atoms_x:
qMoFAKjKBQCoygUAqMoFAKjKBQCoygUAqMoFAKjKBQCoygUAyHwkAMh8JADIfCQAyHwkAMh8JADIfCQAyHwkAMh8JADIfCQAAAAAAAAAAAAAAAAAgIQeAHj1LQB49S0AMFsVACDiLwAQPQ0AoNcyAGCLFABwdTMAsFQUAMDtMwDwBiIA8IEBAPCBAQAQ/R8A

atoms_y:
CEgoAAhIKAAISCgACEgoAAhIKAAISCgACEgoAAhIKAAISCgASGwoAEhsKABIbCgASGwoAEhsKABIbCgASGwoAEhsKABIbCgAAAAAAAAAAAAAAAAAAAAAAACRHgAAkR4AwFkJAPBRCQCAIQkAIIIIAOAbGABwHRgAEMs4AKDlOADwiQgAIOIqACDiKgBgEygA

atoms_z:
YLcLAGC3CwBgtwsAYLcLAGC3CwBgtwsAYLcLAGC3CwBgtwsAOJ4LADieCwA4ngsAOJ4LADieCwA4ngsAOJ4LADieCwA4ngsAAAAAAAAAAAAAAAAAAAAAALgBAAC4AQAAmIcIAPhjCABovAMAkIoDACg2CwBw+AoAaKoLAPiXCwCIVwcA2L8DANi/AwCY3AMA

atoms_occupancy:
gEgoAECcAABAnAAAQJwAAICpAwCAOAEAwCcJAICpAwAAcQIAQI4sAMBFBABAnAAAQJwAAMDUAQBAnAAAAOIEAMDUAQCAOAEAQOEzAABTBwDA1AEAAAk9AACfJAAAahgAAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AwAIkAEAGGQAACT0A

atoms_u_iso:
EL0AABC9AAAQvQAAEL0AABC9AAAQvQAAEL0AABC9AAAQvQAAwNoAAMDaAADA2gAAwNoAAMDaAADA2gAAwNoAAMDaAADA2gAA8IEBAPCBAQDwgQEAwAwBACCTAQAgkwEAQLUAAICiAABQQAEAEDoBAOAoAQCgVAEAUPUAABAIAQCAnAEA4FoBAOBaAQBQvQEA

qdat:
AAAAAAAAAAAIAAIAAAAIgCCICQAQBQEAAh0EBJDEqAgbwIHhOkYCmE8CHXvntTd04hzS8kV0sby+MzN9pb0D+M6OZObzP/4/W5JYujNvq832v13P9uvVlvZ7T3lv77M/vXfd6+f7/9v3f6//RuePu7/+rT97/D/7vynr+H==


compound: Takhtarvumchorr Mt., Khibiny, Kola, Russia
formula_title: <missing>
a: 7.424
b: 5.7083
c: 18.941
alpha: 90
beta: 101.424
gamma: 90
cell_volume: 786.787
crystal_density: 3.366
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
formula:
Ca3.78 Gd.02 Sm.02 Nd.18 Pr.04 Ce.36 La.12 Y.06 Sr.24 Ba.02 (Ti.85 Nb.14 Zr.01) Na2.04 Mn.02 Si4 O15.02 F2.98

pub_title:
 From structure topology to chemical composition. XII. Titanium silicates:
 the crystal chemistry of rinkite, Na2Ca4REETi(Si2O7)2OF3
 Note: sample 3471

atoms_sites:
["CaMH", "GdMH", "SmMH", "NdMH", "PrMH", "CeMH", "LaMH", "YMH", "CaAP", "SrAP", "BaAP", "NdAP", "PrAP", "CeAP", "LaAP", "YAP", "TiMO(1)", "NbMO(1)", "ZrMO(1)", "NaMO(2)", "NaMO(3).75492", "CaMO(3).75492", "MnMO(3).75492", "Si(1)", "Si(2)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "OXOM", "FXOM", "FXOA"]

atoms_x:
ULQFAFC0BQBQtAUAULQFAFC0BQBQtAUAULQFAFC0BQCobyQAqG8kAKhvJACobyQAqG8kAKhvJACobyQAqG8kAAAAAAAAAAAAAAAAAICEHgAAAAAAAAAAAAAAAABYahUAgNwvAEBODQAQvTIAAJsUAHB1MwCAXBQAcD00ADANIgAQ6QEAEOkBAABTIAA=

atoms_y:
+HAoAPhwKAD4cCgA+HAoAPhwKAD4cCgA+HAoAPhwKADYpCgA2KQoANikKADYpCgA2KQoANikKADYpCgA2KQoAAAAAAAAAAAAAAAAAAAAAACQkh4AkJIeAJCSHgCAhQkAIHwJAIAhCQCgjggAEEYYADBiGADQDzkAgEY5ADCQCACQ+SoAkPkqAHAhKAA=

atoms_z:
wKwLAMCsCwDArAsAwKwLAMCsCwDArAsAwKwLAMCsCwBooAsAaKALAGigCwBooAsAaKALAGigCwBooAsAaKALAAAAAAAAAAAAAAAAAAAAAADYDgAA2A4AANgOAAAwiwgACGgIACi2AwCAiwMAsCYLALDbCgAgpwsAEJ4LABBhBwAgqgMAIKoDAEC8AwA=

atoms_occupancy:
QB0qAECcAABAnAAAgKkDAECcAAAAUwcAAHECAIA4AQCAKi0AAFMHAECcAADA1AEAQJwAAICpAwCAOAEAQJwAAEDhMwCAiwgAQJwAAAAJPQAAvR8AgBMcAECcAAAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQDAIB8AQOgdAAAJPQA=

atoms_u_iso:
UEABAFBAAQBQQAEAUEABAFBAAQBQQAEAUEABAFBAAQBwXAEAcFwBAHBcAQBwXAEAcFwBAHBcAQBwXAEAcFwBAFCkAQBQpAEAUKQBANBlAQBAXgIAQF4CAEBeAgBwEQEA4A8BAPDlAQCwxgEAUO8BAKBOAgBAyAEAIMUBAKBOAgAgKQIAICkCANDcAgA=

qdat:
AAAAAAAAAAAIAAIAAAAQgEEICgAQBwEAAjYECSOM8BA8gQLDWJwEmJwKbPctZnzGyDGq6I344t781e3Xr/wOMb4r9MXa9/383vNx+N7v96v+el6vfb/VD5/rb2p3ffxq/d7m3+/d23Z/bry3Ju3fff7w+9//9f3Zdrz7l/==


formula: Ca4.16 Nd.08 Pr.04 Ce.3 La.16 Y.08 Sr.02 (Ti.67 Nb.29 Zr.04) Na2.08 Mn.02 Si4 O15.04 F2.96
compound: Mont Saint-Hilaire, Quebec, Canada
formula_title: <missing>
a: 7.4132
b: 5.6816
c: 18.8455
alpha: 90
beta: 101.370
gamma: 90
cell_volume: 778.173
crystal_density: 3.320
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:
 From structure topology to chemical composition. XII. Titanium silicates:
 the crystal chemistry of rinkite, Na2Ca4REETi(Si2O7)2OF3
 Note: sample H-08-02

atoms_sites:
["CaMH", "NdMH", "PrMH", "CeMH", "LaMH", "YMH", "CaAP", "SrAP", "NdAP", "PrAP", "CeAP", "LaAP", "YAP", "TiMO(1)", "NbMO(1)", "ZrMO(1)", "NaMO(2)", "NaMO(3)", "CaMO(3)", "MnMO(3)", "Si(1)", "Si(2)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "OXOM", "FXOM", "FXOA"]

atoms_x:
aLUFAGi1BQBotQUAaLUFAGi1BQBotQUACGokAAhqJAAIaiQACGokAAhqJAAIaiQACGokAAAAAAAAAAAAAAAAAICEHgBA+y0AQPstAED7LQCwZxUAKNAvALAzDQAgyzIAcLIUALB7MwCgXxQAYBY0AAD8IQAg9wEAIPcBAABsIAA=

atoms_y:
mFgoAJhYKACYWCgAmFgoAJhYKACYWCgAOJAoADiQKAA4kCgAOJAoADiQKAA4kCgAOJAoAAAAAAAAAAAAAAAAAAAAAAAglB4AIJQeACCUHgDAcgkAcF4JAIAhCQCAcggA4DQYALBVGADg6zgAAAg5ANBtCAAQBisAEAYrAMADKAA=

atoms_z:
sLcLALC3CwCwtwsAsLcLALC3CwCwtwsA+KELAPihCwD4oQsA+KELAPihCwD4oQsA+KELAAAAAAAAAAAAAAAAAAAAAABgCQAAYAkAAGAJAABojwgAYGUIAAi9AwDYgwMAiDULAPDhCgAgrAsA2J4LAKBTBwDAtAMAwLQDAAjRAwA=

atoms_occupancy:
gJsvAIA4AQBAnAAAwEUEAABxAgCAOAEAQOEzAECcAACAOAEAQJwAAADiBAAAcQIAgDgBAMDkKABAsxEAAHECAAAJPQCA9SAAQHcbAECcAAAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAAvR8AAEwdAAAJPQA=

atoms_u_iso:
EO8AABDvAAAQ7wAAEO8AABDvAAAQ7wAAABMBAAATAQAAEwEAABMBAAATAQAAEwEAABMBAEB9AQBAfQEAQH0BANAzAQDQ4gEA0OIBANDiAQCg1wAAUMMAABBTAQDgWgEAEGwBAKCfAQAQOgEAAEUBACDFAQCgbQEAoG0BALARAgA=

qdat:
AAAAAAAAAAAIAAIAAAAIgCCICgAQBQEAAh0EBJHEqAgewIFhOkYCjE0DHTvXtTdzJhxT0iV0ka7eJbN7p7UCmE8N9aN7L+8/W7csvher6q3a3031Lbf/6v3911177/8fv/+r+W75/979f//2Y9ePfff/H7/vvHrf77z9/H==


formula: Mn5 (P1.76 Si.18 As.06) O12 H4
compound: Iron Monarch quarry, Iron Knob, South Australia, Australia
pub_title: The crystal structure of gatehouseite
formula_title: <missing>
a: 17.9733
b: 5.6916
c: 9.130
alpha: 90
beta: 90
gamma: 90
cell_volume: 933.970
crystal_density: 3.803
atoms_sites:
["Mn1", "Mn2", "Mn3", "Mn4", "Mn5", "P1", "Si1", "As1", "P2", "Si2", "As2", "O-h1", "O-h2", "O-h3", "O-h4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "H1", "H2", "H3", "H4"]

atoms_x:
mGsaAKDHAQBYsw0AEKIHAAiKEwDozhYA6M4WAOjOFgBogQcAaIEHAGiBBwBg9wIAoHYMAICvAgDQNg0AUMUIABDFBwBAkgoAMJsCAADzFgAQHxIA8E8aANDbFwBAHwAAIPQOAECEBACA8AwA

atoms_y:
MEwQAPBDAwAA8gMAoOghABiIIwAwGQcAMBkHADAZBwDgzQsA4M0LAODNCwAwZywAIHMXAKBTFgCQOC0AcCoaAGC1DQBgKP//8BIHACAkBwCw6AwA4NsRANDDNACgnCcAYLkdAEAkFACg6S8A

atoms_z:
2AguAFBbNgCAGTQAwJE1AFDT//9IYwQASGMEAEhjBACg+goAoPoKAKD6CgAQCAEAMP0sAIAkLgBAK/7/cLcPADCOAACA6g0A4F0NACDbDgAQOgEA0DkAAMAlAQCgCQEAoHIuAAAEKQAAZQQA

atoms_occupancy:
AAk9AAAJPQAACT0AAAk9AAAJPQAAtjUAQH4FAMDUAQAAtjUAQH4FAMDUAQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0AAAk9AAAJPQAACT0A

atoms_u_iso:
cMYAAIDUAABwxgAAwKgAABDWAABAzgAAQM4AAEDOAADwhwAA8IcAAPCHAABQDgEAMPIAAOAPAQAAEwEAUPUAAEDnAADwBAEAMCQBAFDcAADwHQEAsBcBAAATAQBADQMAQA0DAEANAwBADQMA

atoms_aniso_label:
["Mn1", "Mn2", "Mn3", "Mn4", "Mn5", "P1", "Si1", "As1", "P2", "Si2", "As2", "O-h1", "O-h2", "O-h3", "O-h4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12"]

atoms_aniso_u11:
4N0AAODdAABA5wAAAMgAAHD4AADQAQEA0AEBANABAQBwrQAAcK0AAHCtAADgKAEAwNoAACBIAQAgSAEAAHcBAKAJAQDgKAEAoAkBAEAZAQAA+gAAIEgBAEAZAQA=

atoms_aniso_u22:
gNQAAADIAACAuwAAIJkAAADIAABQ3AAAUNwAAFDcAADgkgAA4JIAAOCSAADgKAEAYOoAAOAoAQDAVwEA0M8AAKDwAADA2gAA4CgBANABAQDgKAEAIEgBAMBXAQA=

atoms_aniso_u33:
EKQAAIDUAAAArwAAIJkAAFDDAAAQiwAAEIsAABCLAADwVQAA8FUAAPBVAADA2gAAoAkBACDLAABAnAAAQJwAAIC7AACgCQEAgDgBAAB9AACAOAEAgLsAACDLAAA=

atoms_aniso_u12:
AAAAAFAUAADwCgAAcP7//3D+//9w/v//cP7//3D+///QBwAA0AcAANAHAACgDwAAoA8AAEAfAAAAzv//AAAAAOAuAACw6///4LH//xD1//9g8P//QB8AAMDg//8=

atoms_aniso_u13:
kAEAACDq//+Q6P//QAYAAHDl//8AAAAAAAAAAAAAAABw5f//cOX//3Dl//9g8P//oA8AAKAPAABQ4v//INH//yDR//9g8P//wOD//9Du///A4P//wOD//xDc//8=

atoms_aniso_u23:
UPv//+D8///g/P//UPv//7AEAABQ+///UPv//1D7//+QAQAAkAEAAJABAADgsf//QAYAALA2AACgDwAAcOX//0AfAABQLQAAoA8AAAAAAACgDwAA4LH//8Dg//8=

qdat:
AAAAAAAAAAACAAAAAAAAABEqCCABBCgDCAQgJkGkKZKOBnbIKRbO8IKWeeZ814aWVqso/7Ys6dWtV8pts0d9XWvddnxuv/q9ea/35vu1dvP+vt/7/O////8///69/+99vd381/lsf//txZ3W6M23319fz9dy3Q+33hn4bV==


formula: Na3.66 Ca12 K6.58 Sr.69 Si35 O91.41 F H1.82
compound: Murun massif in Yakutia, Sakha Republic, Siberia, Russia
formula_title: <missing>
a: 32.11
b: 19.77
c: 7.23
alpha: 90
beta: 95.85
gamma: 90
cell_volume: 4565.808
crystal_density: 2.436
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:
 Essential features of the polytypic charoite-96 structure compared to charoite-90
 Note: This structure is polytype charoite-96

atoms_sites:
["Na(1)", "Na(2)", "Ca(1)", "Ca(2)", "Ca(3)", "Ca(4)", "Ca(5)", "Ca(6)", "K(1)", "K(2)", "K(3)", "K(4)", "K(5)", "K(6)", "Sr", "Si(1)", "Si(2)", "Si(3)", "Si(4)", "Si(5)", "Si(6)", "Si(7)", "Si(8)", "Si(9)", "Si(10)", "Si(11)", "Si(12)", "Si(13)", "Si(14)", "Si(15)", "Si(16)", "Si(17)", "Si(18)", "Si(19)", "Si(20)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "O(10)", "O(11)", "O(12)", "O(13)", "O(14)", "O(15)", "O(16)", "O(17)", "O(18)", "O(19)", "O(20)", "O(21)", "O(22)", "O(23)", "O(24)", "O(25)", "O(26)", "O(27)", "O(28)", "O(29)", "O(30)", "O(31)", "O(32)", "O(33)", "O(34)", "O(35)", "O(36)", "O(37)", "O(38)", "O(39)", "O(40)", "O(41)", "O(42)", "O(43)", "O(44)", "O(45)", "O(46)", "O(47)", "O(48)", "O(49)", "O(50)", "O-H", "F", "Wat"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAAAAUAEBCQEQUMdYuWOU5+IqzLpW+/9+f9vfb7/8/f///9/v3+3/9///3///8+/u/93v3e79u/3t/9/un2/W597/v/3/a1dvO35F993/7399+699nT/tu/90/1772++T01//36a//3Z72XOO//97v3/t3q5YzDIEAAAA==


formula: (Ce.62 Y.2 Nd.06 La.03 Pr.01 Sm.01 Gd.02 Dy.02 Er.01 Yb.02) O1.68 F.24
compound: Gregory Rift, northern Tanzania
formula_title: <missing>
a: 5.4203
b: 5.4203
c: 5.4203
alpha: 90
beta: 90
gamma: 90
cell_volume: 159.247
crystal_density: 6.813
atoms_sites: ["CeA", "YA", "NdA", "LaA", "PrA", "SmA", "GdA", "DyA", "ErA", "YbA", "OX", "FX"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEBCDwBAQg8A
atoms_y: AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEBCDwBAQg8A
atoms_z: gIQeAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAICEHgCAhB4AgIQeAEBCDwBAQg8A
atoms_occupancy: gNclAAA1DACAqQMAwNQBAECcAABAnAAAgDgBAIA4AQBAnAAAgDgBAABFMwAAUwcA
atoms_u_iso: UJEAAFCRAABQkQAAUJEAAFCRAABQkQAAUJEAAFCRAABQkQAAUJEAAADIAAAAyAAA
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:
 Fluorine-, yttrium- and lanthanide-rich cerianite-(Ce) from carbonatitic rocks of the
 Kerimasi volcano and surrounding explosion craters, Gregory Rift, northern Tanzania

qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAACAAAAAAAAAAAAAAACAAAAAAAAAgAAgAAAAAAAAAIAAAAAAQAIAAAAAAACAAAAAIAAAAAAAAIAAAAIAgAAAAAQAAACAQAAAABAAAAgIAAAAEAAAEAAAAAEAAAQIAAAAgA==


formula: Fe6.55 Mn.35 Mg.14 Ti1.86 Nb.06 Zr.04 (Si7.92 Al.08) O34.64 K.14 Ca.96 Na.12 F.16 H12.38
compound: Larvik Plutonic Complex, Oslo Region, Norway
formula_title: <missing>
a: 5.329
b: 11.803
c: 11.822
alpha: 101.140
beta: 98.224
gamma: 102.442
cell_volume: 699.079
crystal_density: 3.154
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:
 Sveinbergeite, Ca(Fe2+6Fe3+)Ti2(Si4O12)2O2(OH)5(H2O)4, a new astrophyllite-group mineral
 from the Larvik Plutonic Complex, Oslo Region, Norway: description and crystal structure

atoms_sites:
["Fe2+M1", "Fe3+M1", "MnM1", "MgM1", "Fe2+M2", "Fe3+M2", "MnM2", "MgM2", "Fe2+M3", "Fe3+M3", "MnM3", "MgM3", "Fe2+M4", "Fe3+M4", "MnM4", "MgM4", "TiD", "NbD", "ZrD", "Fe3+D", "SiT1", "AlT1", "SiT2", "AlT2", "SiT3", "AlT3", "SiT4", "AlT4", "WatA", "KA", "CaB1", "NaB1", "WatB2", "O1", "O2", "O3", "O4", "O5", "O6", "O7", "O8", "O9", "O10", "O11", "O12", "O13", "O-H14", "O-H15", "WatX", "O-HX", "FX"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAAAAAAAYAAAAEAAAKAEAGAkAACoQg0AASABMCAkoQCIsjwgyQaQXxUiIzUUE1isrA96URc1XrU+MMF8s/S7c3/bpX8y9fX2q8eun/J3aPv39f5Nfstv++t/8Z/2/V7vqX/Fx97eb+m3e+Paub7/M/8b9f6Sfy+MvpK99==


formula: Pb2 S2 C O6
compound: Trentini mine, Mount Naro, Vicenza Province, Veneto, Italy
formula_title: <missing>
a: 16.320
b: 8.7616
c: 4.5809
alpha: 90
beta: 90
gamma: 90
cell_volume: 655.020
crystal_density: 5.948
atoms_sites: ["Pb", "S1", "C", "O1", "O2", "O3", "O4", "S2"]
atoms_x: WEoIAHAwAACghCsAwMgDANDTEAAw2QAA4GkLACAENgA=
atoms_y: iLkdAEBCDwBAQg8AQEIPAGAGJgBgxgYAQEIPAEBCDwA=
atoms_z: IKgjACA2BADgnhcAgIkyACCUHgDgUQ8AgK4XAKCzOAA=
atoms_occupancy: 0
atoms_u_iso: 0EwBAMDaAADgKAEAIEgBACBIAQAgSAEAYGcBAIA4AQA=
atoms_aniso_label: ["Pb", "S1", "C", "O1", "O2", "O3", "O4", "S2"]
atoms_aniso_u11: IBYBAGDqAABAnAAAgD4AAGBnAQCAOAEAwNQBACDLAAA=
atoms_aniso_u22: 0DMBAOAoAQCAOAEAAHECAIC1AQAgSAEAgDgBAKCGAQA=
atoms_aniso_u33: EJ4BAAB9AADA1AEAgDgBAIC7AABgZwEAgDgBAIA4AQA=
atoms_aniso_u12: YPD//wAAAAAAAAAAAAAAACDX/v+gDwAAAAAAAAAAAAA=
atoms_aniso_u13: kOj//2Bz///AY///AH0AAIC7AAAAg///wGP//yDR//8=
atoms_aniso_u23: 8PH//wAAAAAAAAAAAAAAACBU///A4P//AAAAAAAAAAA=
pub_title:
 Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting
 thiosulphate and carbonate groups: description and crystal structure
 Note: Sample ID FAS-01

qdat:
AAAAAAAAAAAABAAAAEAAAAADADUQJBAAQCIkIAcIIREgVKaHAmKrmZMhaeFFC5yU48fIX3x2RXSWeufHgN5TGr23RmH3983uVrV53Xn4/u9H9lz+dhtzc9f/2dv9+fmu+38neqzu6fP/9P90p9PkXef3m5luxkxldz1/k1==


formula: Pb2 S2 C O6
compound: Erasmus adit, Schwarzleo District, Leogang, Salzburg, Austria
formula_title: <missing>
a: 16.343
b: 8.760
c: 4.592
alpha: 90
beta: 90
gamma: 90
cell_volume: 657.412
crystal_density: 5.926
atoms_sites: ["Pb", "S1", "C", "O1", "O2", "O3", "O4", "S2"]
atoms_x: eEgIAKAoAADQfCsAYKYDALDQEAAw2QAAIFcLANAINgA=
atoms_y: QLYdAEBCDwBAQg8AQEIPADD1JQBg3wYAQEIPAEBCDwA=
atoms_z: 4KEjAOBhBABg4xYAQGoyACCUHgAAIw8A4J4XAFCfOAA=
atoms_occupancy: 0
atoms_u_iso: 8DYBACDLAADA2gAA4CgBAAB3AQDgKAEAwFcBAIAfAQA=
atoms_aniso_label: ["Pb", "S1", "C", "O1", "O2", "O3", "O4", "S2"]
atoms_aniso_u11: EAgBAECcAABAnAAAgLsAAMBXAQAA+gAAoIYBAOCrAAA=
atoms_aniso_u22: wCUBAKAJAQCAOAEAoAMCAECWAQBgZwEAAHcBAAB3AQA=
atoms_aniso_u33: cHUBAIC7AACAuwAA4KsAAGBnAQCgCQEAoAkBAIA4AQA=
atoms_aniso_u12: 0O7//wAAAAAAAAAAAAAAAECi///A4P//AAAAAAAAAAA=
atoms_aniso_u13: 0O7//4DB///gsf//gD4AAAB9AADgsf//wNoAAMDg//8=
atoms_aniso_u23: wPn//wAAAAAAAAAAAAAAAOA0//8gTgAAAAAAAAAAAAA=
pub_title:
 Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting
 thiosulphate and carbonate groups: description and crystal structure
 Note: Sample ID FAS-02

qdat:
AAAAAAAAAAAABAAAAEAAAAADACUQJBAAQCIkIAUIIREgqKqLBGLPO6MicsJKD5kUo0vIruTWjumkdeefgLySG2++TMN2/avWea37+vK5fc+L/x3+7i/6///+fZO797NP/u9//7rev/e+8/+63k3wk99m6jU/jNlT129v3r==


formula: Pb2 S2 C O6
compound: Friedrich-Christian mine, Schapbach, Black Forest,
formula_title: <missing>
a: 16.326
b: 8.773
c: 4.583
alpha: 90
beta: 90
gamma: 90
cell_volume: 656.414
crystal_density: 5.935
atoms_sites: ["Pb", "S1", "C", "O1", "O2", "O3", "O4", "S2"]
atoms_x: iEwIAOAuAAAwbSsAwK8DAGDVEACg1wAAAG0LANAINgA=
atoms_y: iLkdAEBCDwBAQg8AQEIPADDcJQBgxgYAQEIPAEBCDwA=
atoms_z: wKgjAOB6BAAgxBYA4HkyAMCjHgCAYQ8AQAwYAMCdOAA=
atoms_occupancy: 0
atoms_u_iso: UEABADDyAACgCQEAIEgBAOClAQDgKAEAgLUBANAzAQA=
atoms_aniso_label: ["Pb", "S1", "C", "O1", "O2", "O3", "O4", "S2"]
atoms_aniso_u11: oCIBACDLAAAgywAAAPoAAGBnAQDgKAEAIEICAKAJAQA=
atoms_aniso_u22: MCQBAMDaAABAGQEA4KUBAOClAQBg6gAAwNQBACBIAQA=
atoms_aniso_u33: IHoBAOAoAQCAOAEA4CgBAAD0AQDAVwEAQBkBACBIAQA=
atoms_aniso_u12: 0O7//wAAAAAAAAAAAAAAAECi///gsf//AAAAAAAAAAA=
atoms_aniso_u13: 0O7//2Dw///AXQAAYG0AAKCMAACAwf//4KsAAIDB//8=
atoms_aniso_u23: EPX//wAAAAAAAAAAAAAAAIBE//9AHwAAAAAAAAAAAAA=
pub_title:
 Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting
 thiosulphate and carbonate groups: description and crystal structure
 Note: Sample ID FAS-03
 Baden-Wurttemberg, Germany

qdat:
AAAAAAAAAAAABAAAAEAAAAADADUQJBAAQCIkIA0IIREgpK6HAmKtuaUhaeJGC5kV40uIfbR2TeSmWubPgP5TE6/fTGN75tXudTr7mtu5bN+H5p3ufB/1d+6+u/9v07G/t24vb3m92be/1f/prafIuefvtpn/RMjKun7/l5==


formula: Ag.985 Cu.005
compound: northeast USSR
pub_title: Native silver and its new structural modifications Note: sample DV-300, known as silver 4H
formula_title: <missing>
a: 2.88
b: 2.88
c: 9.62
alpha: 90
beta: 90
gamma: 120
cell_volume: 69.102
crystal_density: 5.124
atoms_sites: ["Ag", "Cu", "Fe", "Cr", "Ni"]
atoms_x: VVgUAFVYFABVWBQAVVgUAFVYFAA=
atoms_y: q7AoAKuwKACrsCgAq7AoAKuwKAA=
atoms_z: QEIPAEBCDwBAQg8AQEIPAEBCDwA=
atoms_occupancy: cCY8AOBHAACQAQAAkAEAAJABAAA=
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAABAAAAAAAAAAAAAAAAAAAAgMAAAIAAAAAQAAAAAAEAAAAIAACAAACAABACAAAAAAjACwAAQAAACACCAAgAAAAAMABAAiAcABCAAIAgACAAgBBgAgAIBAAEAAAQgAAEAgQAAFAwBEAEAIBAAABA==


formula: Ag.985 Cu.005
compound: northeast USSR
pub_title: Native silver and its new structural modifications Note: Sample DV-300
formula_title: <missing>
a: 4.084
b: 4.084
c: 4.084
alpha: 90
beta: 90
gamma: 90
cell_volume: 68.117
crystal_density: 10.396
atoms_sites: ["Ag", "Cu", "Fe", "Cr", "Ni"]
atoms_x: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_y: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_z: AAAAAAAAAAAAAAAAAAAAAAAAAAA=
atoms_occupancy: cCY8AOBHAACQAQAAkAEAAJABAAA=
atoms_u_iso: 0
atoms_aniso_label: "<missing>"
atoms_aniso_u11: 0
atoms_aniso_u22: 0
atoms_aniso_u33: 0
atoms_aniso_u12: 0
atoms_aniso_u13: 0
atoms_aniso_u23: 0
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAIAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAgAABAAAAAAAAAAAAAEAAAAAAAABAACAAAAAAAAAACAAAAAAAIAAAAAAAAAAAgAAAAACABAAAAAAAAQAAA==


formula: B O2 H
compound: La Fossa Crater, Vulcano, Aeolian Islands, Italy
formula_title: <missing>
a: 7.127
b: 8.842
c: 6.773
alpha: 90
beta: 93.21
gamma: 90
cell_volume: 426.144
crystal_density: 2.049
atoms_sites: ["B1", "B2", "B3", "O1", "O2", "O3", "O4", "O5", "O6", "H1", "H2", "H3"]
atoms_x: wEoOAODxDwAIdhgASDcNAHiQFQAQxhUAkJURADgMAgCoYR4AgLsAAIDZ+//AlyAA
atoms_y: GF79/3jfDACo6QkAOLUDAFj8DwAozQAAIC30/ygc/f84Lg0AwBD4/wAS/f8ATQgA
atoms_z: 2LMyAFieOwBYASkAGLU8AGjKMQCIsikAOKs1AHAnLAAYoB8AQKwnAKBgMQDgCRsA
atoms_occupancy: 0
atoms_u_iso: 0OgAAODdAAAg5AAAQOcAAJAtAQDgDwEAIBYBAIAfAQCgOwEAwEsDAIAmBADgIgIA
atoms_aniso_label: ["B1", "B2", "B3", "O1", "O2", "O3", "O4", "O5", "O6"]
atoms_aniso_u11: UFkBAOAoAQAARQEAIHoBACD3AQDwswEAMNMBANBlAQAwBQIA
atoms_aniso_u22: oKUAAKC+AABAtQAAQIMAAOCrAABAnAAAMI4AAFD1AACwswAA
atoms_aniso_u33: AMgAANC2AADwuQAA4MQAAHD4AAAw8gAA8OsAABAIAQDADAEA
atoms_aniso_u12: QAYAAAAAAAAAAAAAMN///4DB///w8f//ECcAAGDw///QBwAA
atoms_aniso_u13: 4HkAAIA+AADgRwAAQGoAAGC4AACAuwAAMI4AAABLAACwzAAA
atoms_aniso_u23: wBIAAAAAAAAwEQAA4OP//zDf//9gCQAAcBcAADDG//+AJQAA
pub_title:
 Clinometaborite, natural beta-metaboric acid,
 from La Fossa Crater, Vulcano, Aeolian Islands, Italy

qdat:
AAAAAAAAAAAAAACAAABEAAACAgABIEAiIQAgghFgAFIBQGQYgzRAQQBJGCNowwh0GF7wvgg0jHtKh9tyk3Jm9WCXvk3urH/3vd53arbud3ry13ftf5l76n9s/Xv/+/9ff3e33/dMv/Z3/N/z9u7f//e3vv9//v7//nx9v9==


formula: Ce11.4 La5.82 Nd3.18 Pr1.56 Sm.36 Gd.24 Ca4.68 Sr1.02 Cs6 K2.22 Si70 O203.11 F6.76 H46.02
compound: moraine of the Darai-Pioz glacier, Alai mountain ridge,
formula_title: <missing>
a: 21.9148
b: 21.9148
c: 21.9148
alpha: 90
beta: 90
gamma: 90
cell_volume: 10524.769
crystal_density: 3.070
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 crystal structure and crystal chemistry of mendeleevite-(Ce),
 (Cs,_)6(_,Cs)6(_,K)6(REE,Ca,_)30(Si70O175)(H2O,OH,F,_)35,
 a potential microporous material
 Tien-Shan mountains, northern Tajikistan

atoms_sites:
["CeM(1)", "LaM(1)", "NdM(1)", "PrM(1)", "SmM(1)", "GdM(1)", "CeM(2A)", "LaM(2A)", "NdM(2A)", "PrM(2A)", "SmM(2A)", "GdM(2A)", "CaM(2A)", "CeM(2B)", "LaM(2B)", "NdM(2B)", "PrM(2B)", "CaM(3)", "SrM(3)", "CeM(3)", "LaM(3)", "NdM(3)", "CsA(1)", "CsA(2)", "KB(1)", "KB(2)", "Si(1)", "Si(2)", "Si(3)", "Si(4)", "Si(5)", "Si(6)", "Si(7)", "O(1)", "O(2)", "O(3)", "O(4)", "O(5)", "O(6)", "O(7)", "O(8)", "O(9)", "O(10)", "O(11)", "O(12)", "O(13)", "O(14)", "O(15)", "O(16)", "O(17)", "O(18)", "O(19)", "F", "WatO(20)", "O-HO(20)", "WatO(21)", "O-HO(21)", "WatO(22)", "WatO(23)", "O-HO(23)", "FO(23)", "WatO(24)", "WatO(25)", "O-HO(25)", "FO(25)", "WatO(26)", "WatO(27)"]

atoms_x:

atoms_y:

atoms_z:

atoms_occupancy:

atoms_u_iso:

qdat:
AAAABABAIECCAEIRERASJJIJJCQlKkSqoVVRqKVWlaytpcZtq7R2tmva+us8j8vm8rUtUqYDUEFIAKAAgACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==


formula: Ba Ti O3
compound: Synthetic
pub_title: Crystal structure of dense nanocrystalline BaTiO3 ceramics Note: phase T (tetragonal)
formula_title: BaTiO3
a: 3.9988
b: 3.9988
c: 4.0222
alpha: 90
beta: 90
gamma: 90
cell_volume: 64.317
crystal_density: 6.021
atoms_sites: ["Ba", "Ti", "O1", "O2"]
atoms_x: AAAAAICEHgCAhB4AgIQeAA==
atoms_y: AAAAAICEHgCAhB4AAAAAAA==
atoms_z: AAAAAFClHgDwEP//oE8fAA==
atoms_occupancy: 0
atoms_u_iso: gPYLAEAZAQCgCQEA4KsAAA==
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAABgAAAAAAAIAAAAAAoAAAAAEAAAABQAAAAAAAABQAAAUAAALAAAFAAAEAAAgAADAAAAAARAACgAFwABQACwAAgAGAAAABQASABuAJgAAAJACIAAACQCIAuAKgRwAQFcAACG==


formula: Ba Ti O3
compound: Synthetic
pub_title: Crystal structure of dense nanocrystalline BaTiO3 ceramics Note: phase O (orthorhombic)
formula_title: <missing>
a: 4.0094
b: 5.6214
c: 5.6386
alpha: 90
beta: 90
gamma: 90
cell_volume: 127.085
crystal_density: 6.094
atoms_sites: ["Ba", "Ti", "O1", "O2"]
atoms_x: AAAAAICEHgAAAAAAgIQeAA==
atoms_y: AAAAAAAAAACAhB4A0O0tAA==
atoms_z: AAAAAMAgHwBA6B0AQCQtAA==
atoms_occupancy: 0
atoms_u_iso: AL4KAAD6AAAgvwIAgLUBAA==
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:
AAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAA4AAAAAAAMAAAAAASAAAAADAAAAAcAAAAAAAAAcAAANgAACYAADQAABgAAKgAB8AAAAAEQAA8AB3AAdAAlABOAB4AAAAdAC+AXQBWAAAB/ARwAAAMQPYC6BeBVgBgvwAAI==


formula: Ba Ti O3
compound: Synthetic
pub_title: Neutron diffraction study of orthorhombic BaTiO3 Note: orthorhombic structure
formula_title: <missing>
a: 3.990
b: 5.669
c: 5.682
alpha: 90
beta: 90
gamma: 90
cell_volume: 128.523
crystal_density: 6.026
atoms_sites: ["Ba", "Ti", "O1", "O2"]
atoms_x: AAAAAICEHgAAAAAAgIQeAA==
atoms_y: AAAAAAAAAAAAAAAAIHEPAA==
atoms_z: AAAAAMAgHwBA6B0AIHcOAA==
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
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAABgAAAAAAAYAAAAAAUAAAAAMAAAAAwAAAAAAAADgAAAOAAAEgAAHgAAGAAA8AADgAAAAAIgAHgADoADwADIAHwALAAAABoAOwA/AHoAAAPoByAAAJgDeA/AOgFkCAB2AAAx==


formula: Ba Ti O3
compound: Synthetic
pub_title: Neutron diffraction study of orthorhombic BaTiO3 Note: tetragonal structure
formula_title: BaTiO3
a: 3.986
b: 3.986
c: 4.026
alpha: 90
beta: 90
gamma: 90
cell_volume: 63.966
crystal_density: 6.054
atoms_sites: ["Ba", "Ti", "OI", "OII1"]
atoms_x: AAAAAICEHgCAhB4AgIQeAA==
atoms_y: AAAAAICEHgCAhB4AAAAAAA==
atoms_z: AAAAAKAsEACgmP7/gGcOAA==
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
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAwAAAAAAAIAAAAAAkAAAAAKAAAAAoAAAAAAAAAoAAAmAAAIgAAEgAACAAAkAACwAAAAAggAKoAEsAAkAEMAEYACgAAABEAlACVgIkAAARoCDAAABECJAmIIoRGQBIjAACA==


formula: Ba Ti O3
compound: Synthetic
pub_title: Structures of the ferroelectric phases of barium titanate Note: T = 15 K
formula_title: BaTiO3
a: 4.00360
b: 4.00360
c: 4.00360
alpha: 89.839
beta: 89.839
gamma: 89.839
cell_volume: 64.172
crystal_density: 6.034
atoms_sites: ["Ba", "Ti", "O"]
atoms_x: AAAAAIC8HQDQLh8A
atoms_y: AAAAAIC8HQDQLh8A
atoms_z: AAAAAIC8HQCQLQEA
atoms_occupancy: 0
atoms_u_iso: kOj//8ArAABAHwAA
atoms_aniso_label: ["Ba", "Ti", "O"]
atoms_aniso_u11: kOj//8ArAADwIwAA
atoms_aniso_u22: kOj//8ArAADwIwAA
atoms_aniso_u33: kOj//8ArAADgFQAA
atoms_aniso_u12: 8L///2AJAABABgAA
atoms_aniso_u13: 8L///2AJAADwCgAA
atoms_aniso_u23: 8L///2AJAADwCgAA
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAAAAAAAAEAAAAAgAAAAAAAABAAAAMAAAAAAACAAAAAAAAAACAAAAAAAAAGAABAAAAABAACAAAAAAABAAAAAoAFAAAAFAAQAAABAAAAAAEAFAAABgAAAA==


formula: Ba Ti O3
compound: Synthetic
pub_title: Structures of the ferroelectric phases of barium titanate Note: T = 20 K
formula_title: BaTiO3
a: 4.0036
b: 4.0036
c: 4.0036
alpha: 89.840
beta: 89.840
gamma: 89.840
cell_volume: 64.172
crystal_density: 6.034
atoms_sites: ["Ba", "Ti", "O"]
atoms_x: AAAAAADJHQDAOR8A
atoms_y: AAAAAADJHQDAOR8A
atoms_z: AAAAAADJHQCwMAEA
atoms_occupancy: 0
atoms_u_iso: 0O7//xAnAAAgHAAA
atoms_aniso_label: ["Ba", "Ti", "O"]
atoms_aniso_u11: 0O7//xAnAACQGgAA
atoms_aniso_u22: 0O7//xAnAACQGgAA
atoms_aniso_u33: 0O7//xAnAACwHQAA
atoms_aniso_u12: 0Lz//5ABAACQAQAA
atoms_aniso_u13: 0Lz//5ABAABABgAA
atoms_aniso_u23: 0Lz//5ABAABABgAA
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAAAAAAAAEAAAAAgAAAAAAAABAAAAMAAAAAAACAAAAAAAAAACAAAAAAAAAGAABAAAAABAACAAAAAAABAAAAAoAFAAAAFAAQAAABAAAAAAEAFAAAAgAAAA==


formula: Ba Ti O3
compound: Synthetic
pub_title: Structures of the ferroelectric phases of barium titanate Note: T = 40 K
formula_title: BaTiO3
a: 4.0035
b: 4.0035
c: 4.0035
alpha: 89.843
beta: 89.843
gamma: 89.843
cell_volume: 64.167
crystal_density: 6.035
atoms_sites: ["Ba", "Ti", "O"]
atoms_x: AAAAAHCVHQAADh8A
atoms_y: AAAAAHCVHQAADh8A
atoms_z: AAAAAHCVHQDwHQEA
atoms_occupancy: 0
atoms_u_iso: IOr//7AdAADAKwAA
atoms_aniso_label: ["Ba", "Ti", "O"]
atoms_aniso_u11: IOr//7AdAADwPAAA
atoms_aniso_u22: IOr//7AdAADwPAAA
atoms_aniso_u33: IOr//7AdAACADAAA
atoms_aniso_u12: EMP//zD4//8gAwAA
atoms_aniso_u13: EMP//zD4//8AGQAA
atoms_aniso_u23: EMP//zD4//8AGQAA
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAAAAAAAAEAAAAAgAAAAAAAABAAAAMAAAAAAACAAAAAAAAAACAAAAAAAAAGAABAAAAABAACAAAAAAABAAAAAYAFAAAAFAAQAAABAAAAAAEAFAAAAgAAAA==


formula: Ba Ti O3
compound: Synthetic
pub_title: Structures of the ferroelectric phases of barium titanate Note: T = 70 K
formula_title: BaTiO3
a: 4.0042
b: 4.0042
c: 4.0042
alpha: 89.837
beta: 89.837
gamma: 89.837
cell_volume: 64.201
crystal_density: 6.032
atoms_sites: ["Ba", "Ti", "O"]
atoms_x: AAAAAFCSHQDgCh8A
atoms_y: AAAAAFCSHQDgCh8A
atoms_z: AAAAAFCSHQBwEQEA
atoms_occupancy: 0
atoms_u_iso: QO3//+AVAABQLQAA
atoms_aniso_label: ["Ba", "Ti", "O"]
atoms_aniso_u11: QO3//zACAABAOAAA
atoms_aniso_u22: QO3//zACAABAOAAA
atoms_aniso_u33: QO3//zACAAAAGQAA
atoms_aniso_u12: 0Lz//8D5//+gDwAA
atoms_aniso_u13: 0Lz//8D5///gFQAA
atoms_aniso_u23: 0Lz//8D5///gFQAA
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAAAAAAAAIAAAABAAAAAAAAABAAAAMAAAAAAACAAAAAAAAAACAAAAAAAAAGAABAAAAABAACAAAAAAABAAAAAoAGAAAAFAAgAAABAAAAAAEAFAAABgAAAA==


formula: Ba Ti O3
compound: Synthetic
pub_title: Structures of the ferroelectric phases of barium titanate Note: T = 150 K
formula_title: BaTiO3
a: 4.0057
b: 4.0057
c: 4.0057
alpha: 89.846
beta: 89.846
gamma: 89.846
cell_volume: 64.273
crystal_density: 6.025
atoms_sites: ["Ba", "Ti", "O"]
atoms_x: AAAAAACwHQDQFR8A
atoms_y: AAAAAACwHQDQFR8A
atoms_z: AAAAAACwHQDQGgEA
atoms_occupancy: 0
atoms_u_iso: wBIAACA1AADAKwAA
atoms_aniso_label: ["Ba", "Ti", "O"]
atoms_aniso_u11: wBIAALA2AAAQQAAA
atoms_aniso_u22: wBIAALA2AAAQQAAA
atoms_aniso_u33: wBIAALA2AABgCQAA
atoms_aniso_u12: 8Kb//8Dg//9ABgAA
atoms_aniso_u13: 8Kb//8Dg//+gDwAA
atoms_aniso_u23: 8Kb//8Dg//+gDwAA
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAAAAAAAAAAAAAAAAAAIAAAABAAAAAAAAABAAAAMAAAAAAACAAAAAAAAAACAAAAAAAAAGAACAAAAABAACAAAAAAABAAAAAwAKAAAAGAAgAAACAAAAAAEAFAAABgAAAA==


formula: Ba Ti O3
compound: Synthetic
pub_title: Structures of the ferroelectric phases of barium titanate Note: T = 190 K
formula_title: <missing>
a: 3.9828
b: 5.6745
c: 5.6946
alpha: 90
beta: 90
gamma: 90
cell_volume: 128.700
crystal_density: 6.018
atoms_sites: ["Ba", "Ti", "O1", "O2"]
atoms_x: AAAAAICEHgAAAAAAgIQeAA==
atoms_y: AAAAAAAAAAAAAAAAkKEPAA==
atoms_z: AAAAACCOHwCg2B0AuCkPAA==
atoms_occupancy: 0
atoms_u_iso: EA4AAKAoAAAASwAAECcAAA==
atoms_aniso_label: ["Ba", "Ti", "O1", "O2"]
atoms_aniso_u11: oEEAALAdAADAXQAAsB0AAA==
atoms_aniso_u22: QIMAAOAuAAAQQAAAEA4AAA==
atoms_aniso_u33: IJkAAMArAAAwQwAA4EcAAA==
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAADIAAA==
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAABgAAAAAAAYAAAAAAUAAAAAYAAAAB4AAAAAAAAFgAAAZAAAMgAAKwAAGAACUAALwAAAAAQQANgAOsAJwAKIAOQAXAAAACsAukD6gOmAAAXIFjAAASgGrCuhEwRhOAHmgAEg==


formula: Ba Ti O3
compound: Synthetic
pub_title: Structures of the ferroelectric phases of barium titanate Note: T = 210 K
formula_title: <missing>
a: 3.9806
b: 5.6710
c: 5.6904
alpha: 90
beta: 90
gamma: 90
cell_volume: 128.455
crystal_density: 6.029
atoms_sites: ["Ba", "Ti", "O1", "O2"]
atoms_x: AAAAAICEHgAAAAAAgIQeAA==
atoms_y: AAAAAAAAAAAAAAAAkKEPAA==
atoms_z: AAAAAPBjHwCg2B0AKCgPAA==
atoms_occupancy: 0
atoms_u_iso: wBIAALBPAADwVQAAcDAAAA==
atoms_aniso_label: ["Ba", "Ti", "O1", "O2"]
atoms_aniso_u11: ADIAAHAwAACQZQAAYCIAAA==
atoms_aniso_u22: gKIAAJBMAAAAMgAAYAkAAA==
atoms_aniso_u33: 0J0AABByAABAagAAAGQAAA==
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAA8CMAAA==
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAABgAAAAAAAYAAAAAASAAAAAYAAAAB4AAAAAAAADQAAAdAAAMQAAGQAAGAABKAAHwAAAAAIQAGgAPUAFwALEAKQALAAAACkAZUD+QOiAAAbkDxAAAJQCtBfgmYJRGADyQACw==


formula: Ba Ti O3
compound: Synthetic
pub_title: Structures of the ferroelectric phases of barium titanate Note: T = 230 K
formula_title: <missing>
a: 3.9841
b: 5.6741
c: 5.6916
alpha: 90
beta: 90
gamma: 90
cell_volume: 128.665
crystal_density: 6.019
atoms_sites: ["Ba", "Ti", "O1", "O2"]
atoms_x: AAAAAICEHgAAAAAAgIQeAA==
atoms_y: AAAAAAAAAAAAAAAAAIcPAA==
atoms_z: AAAAAPD/HgAQCR4AuCQPAA==
atoms_occupancy: 0
atoms_u_iso: ABJ6AKBzAAAASwAAADIAAA==
atoms_aniso_label: ["Ba", "Ti", "O1", "O2"]
atoms_aniso_u11: oEEAANAHAAAwdQAAwBIAAA==
atoms_aniso_u22: EFkAABCLAABwMAAAoEEAAA==
atoms_aniso_u33: sJoAAADIAADwPAAAoEEAAA==
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAoA8AAA==
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAABgAAAAAAAYAAAAAAUAAAAAIAAAABwAAAAAAAAFgAAAZAAAMgAAGgAAGAABEAAHwAAAAAQQANgAOsAFwAKIAOAALAAAACsAiED6gOkAAAfIFiAAASgGrC/AkwZiGAFmgACg==


formula: Ba Ti O3
compound: Synthetic
pub_title: Structures of the ferroelectric phases of barium titanate Note: T = 250 K
formula_title: <missing>
a: 3.9855
b: 5.6738
c: 5.6903
alpha: 90
beta: 90
gamma: 90
cell_volume: 128.674
crystal_density: 6.019
atoms_sites: ["Ba", "Ti", "O1", "O2"]
atoms_x: AAAAAICEHgAAAAAAgIQeAA==
atoms_y: AAAAAAAAAAAAAAAA8KoPAA==
atoms_z: AAAAAEBGHwCgvx0AcCsPAA==
atoms_occupancy: 0
atoms_u_iso: EA4AACBnAAAwXAAAoEEAAA==
atoms_aniso_label: ["Ba", "Ti", "O1", "O2"]
atoms_aniso_u11: UEYAACA1AABAagAAYCIAAA==
atoms_aniso_u22: IIAAAICJAAAwQwAAcDAAAA==
atoms_aniso_u33: kAEAADB1AAAgZwAAoHMAAA==
atoms_aniso_u12: AAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u13: AAAAAAAAAAAAAAAAAAAAAA==
atoms_aniso_u23: AAAAAAAAAAAAAAAAYDsAAA==
qdat:
AAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAABgAAAAAAAYAAAAAAUAAAAAYAAAABwAAAAAAAADgAAAdAAAMgAAGgAAGAABEAAHgAAAAAQgAFgAOoAFwAKIAOQAKAAAACsAaID+gOkAAAfIDiAAAKgCqBfAkgJiGADngACg==


