LMucko/crystallography-open-database huggingface dataset:
Structural changes and oxidation of ferroan phlogopite with increasing temperature: in situ neutron powder diffraction and Fourier transform infrared spectroscopy Sample: T = 600 C
Chon, C.-M.; Lee, C.-K.; Song, Y.; Kim, S. A.; Physics and Chemistry of Minerals 33 (2006) 289–299; doi:10.1007/s00269-005-0045-y

data_9010868
_publ_section_title
;
 Structural changes and oxidation of ferroan phlogopite with increasing
 temperature: in situ neutron powder diffraction and Fourier transform
 infrared spectroscopy
 Sample: T = 600 C
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              289
_journal_page_last               299
_journal_paper_doi               10.1007/s00269-005-0045-y
_journal_volume                  33
_journal_year                    2006
_chemical_compound_source        'Quebec, Canada'
_chemical_formula_sum
'Al1.42 F0.2 Fe0.42 H1.8 K Mg2.28 O11.8 Si2.76 Ti0.12'
_chemical_name_mineral           Phlogopite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.078
_cell_angle_gamma                90
_cell_length_a                   5.3468
_cell_length_b                   9.2616
_cell_length_c                   10.3101
_cell_formula_units_Z            2
_cell_volume                     502.678
_database_code_amcsd             0009038
_diffrn_ambient_temperature      873.15
_exptl_crystal_density_diffrn    2.867
_cod_original_formula_sum
'K Mg2.28 Fe.42 Al1.42 Ti.12 Si2.76 O11.8 H1.8 F.2'
_cod_database_code               9010868
Structural changes and oxidation of ferroan phlogopite with increasing temperature: in situ neutron powder diffraction and Fourier transform infrared spectroscopy Sample: T = 700 C
Chon, C.-M.; Lee, C.-K.; Song, Y.; Kim, S. A.; Physics and Chemistry of Minerals 33 (2006) 289–299; doi:10.1007/s00269-005-0045-y

data_9010869
_publ_section_title
;
 Structural changes and oxidation of ferroan phlogopite with increasing
 temperature: in situ neutron powder diffraction and Fourier transform
 infrared spectroscopy
 Sample: T = 700 C
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              289
_journal_page_last               299
_journal_paper_doi               10.1007/s00269-005-0045-y
_journal_volume                  33
_journal_year                    2006
_chemical_compound_source        'Quebec, Canada'
_chemical_formula_sum
'Al1.42 F0.2 Fe0.42 H1.8 K Mg2.28 O11.8 Si2.76 Ti0.12'
_chemical_name_mineral           Phlogopite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.075
_cell_angle_gamma                90
_cell_length_a                   5.3497
_cell_length_b                   9.2660
_cell_length_c                   10.3250
_cell_formula_units_Z            2
_cell_volume                     503.921
_database_code_amcsd             0009039
_diffrn_ambient_temperature      973.15
_exptl_crystal_density_diffrn    2.860
_cod_original_formula_sum
'K Mg2.28 Fe.42 Al1.42 Ti.12 Si2.76 O11.8 H1.8 F.2'
_cod_database_code               9010869
Structural changes and oxidation of ferroan phlogopite with increasing temperature: in situ neutron powder diffraction and Fourier transform infrared spectroscopy Sample: T = 800 C
Chon, C.-M.; Lee, C.-K.; Song, Y.; Kim, S. A.; Physics and Chemistry of Minerals 33 (2006) 289–299; doi:10.1007/s00269-005-0045-y

data_9010870
_publ_section_title
;
 Structural changes and oxidation of ferroan phlogopite with increasing
 temperature: in situ neutron powder diffraction and Fourier transform
 infrared spectroscopy
 Sample: T = 800 C
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              289
_journal_page_last               299
_journal_paper_doi               10.1007/s00269-005-0045-y
_journal_volume                  33
_journal_year                    2006
_chemical_compound_source        'Quebec, Canada'
_chemical_formula_sum
'Al1.42 F0.2 Fe0.42 H1.8 K Mg2.28 O11.8 Si2.76 Ti0.12'
_chemical_name_mineral           Phlogopite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.050
_cell_angle_gamma                90
_cell_length_a                   5.3528
_cell_length_b                   9.2708
_cell_length_c                   10.3411
_cell_formula_units_Z            2
_cell_volume                     505.300
_database_code_amcsd             0009040
_diffrn_ambient_temperature      1073.15
_exptl_crystal_density_diffrn    2.852
_cod_original_formula_sum
'K Mg2.28 Fe.42 Al1.42 Ti.12 Si2.76 O11.8 H1.8 F.2'
_cod_database_code               9010870
The crstal chemistry of lithium and Fe3+ in synthetic orthopyroxene Sample: LMFPX3
Camara, F.; Iezzi, G.; Tiepolo, M.; Oberti, R.; Physics and Chemistry of Minerals 33 (2006) 475–483; doi:10.1007/s00269-006-0094-x

data_9010871
_publ_section_title
;
 The crstal chemistry of lithium and Fe3+ in synthetic orthopyroxene
 Sample: LMFPX3
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              475
_journal_page_last               483
_journal_paper_doi               10.1007/s00269-006-0094-x
_journal_volume                  33
_journal_year                    2006
_chemical_formula_sum            'Fe0.47 Li0.2 Mg1.33 O6 Si2'
_chemical_name_mineral           Enstatite
_space_group_IT_number           61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   18.2113
_cell_length_b                   8.8172
_cell_length_c                   5.2050
_cell_formula_units_Z            8
_cell_volume                     835.781
_database_code_amcsd             0009041
_exptl_crystal_density_diffrn    3.372
_cod_original_formula_sum        'Mg1.33 Fe.47 Li.2 Si2 O6'
_cod_database_code               9010871
The crstal chemistry of lithium and Fe3+ in synthetic orthopyroxene Sample: LMFPX4
Camara, F.; Iezzi, G.; Tiepolo, M.; Oberti, R.; Physics and Chemistry of Minerals 33 (2006) 475–483; doi:10.1007/s00269-006-0094-x

data_9010872
_publ_section_title
;
 The crstal chemistry of lithium and Fe3+ in synthetic orthopyroxene
 Sample: LMFPX4
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              475
_journal_page_last               483
_journal_paper_doi               10.1007/s00269-006-0094-x
_journal_volume                  33
_journal_year                    2006
_chemical_formula_sum            'Fe0.47 Li0.2 Mg1.33 O6 Si2'
_chemical_name_mineral           Enstatite
_space_group_IT_number           61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   18.2369
_cell_length_b                   8.8246
_cell_length_c                   5.2076
_cell_formula_units_Z            8
_cell_volume                     838.077
_database_code_amcsd             0009042
_exptl_crystal_density_diffrn    3.362
_cod_original_formula_sum        'Mg1.33 Fe.47 Li.2 Si2 O6'
_cod_database_code               9010872
The crstal chemistry of lithium and Fe3+ in synthetic orthopyroxene Sample: LMFPX5
Camara, F.; Iezzi, G.; Tiepolo, M.; Oberti, R.; Physics and Chemistry of Minerals 33 (2006) 475–483; doi:10.1007/s00269-006-0094-x

data_9010873
_publ_section_title
;
 The crstal chemistry of lithium and Fe3+ in synthetic orthopyroxene
 Sample: LMFPX5
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              475
_journal_page_last               483
_journal_paper_doi               10.1007/s00269-006-0094-x
_journal_volume                  33
_journal_year                    2006
_chemical_formula_sum            'Fe0.47 Li0.2 Mg1.33 O6 Si2'
_chemical_name_mineral           Enstatite
_space_group_IT_number           61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   18.2162
_cell_length_b                   8.8194
_cell_length_c                   5.2054
_cell_formula_units_Z            8
_cell_volume                     836.279
_database_code_amcsd             0009043
_exptl_crystal_density_diffrn    3.370
_cod_original_formula_sum        'Mg1.33 Fe.47 Li.2 Si2 O6'
_cod_database_code               9010873
Monte Carlo simulation of mixing in Ca3Fe2Ge3O12-Ca4Ge4O12 garnets and implications for the thermodynamic stability of pyrope-majorite solid solution Sample: XRD
Vinograd, V. L.; Winkler, B.; Wilson, D. J.; Putnis, A.; Gale, J. D.; Physics and Chemistry of Minerals 33 (2006) 533–544; doi:10.1007/s00269-006-0099-5

data_9010874
_publ_section_title
;Monte Carlo simulation of mixing in Ca3Fe2Ge3O12-Ca4Ge4O12 garnets and
 implications for the thermodynamic stability of pyrope-majorite solid
 solution Sample: XRD
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              533
_journal_page_last               544
_journal_paper_doi               10.1007/s00269-006-0099-5
_journal_volume                  33
_journal_year                    2006
_chemical_formula_structural     Ca4Ge4O12
_chemical_formula_sum            'Ca Ge O3'
_symmetry_space_group_name_H-M   'I 41/a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   12.535
_cell_length_b                   12.535
_cell_length_c                   12.37
_cell_formula_units_Z            32
_cell_volume                     1943.651
_database_code_amcsd             0009044
_exptl_crystal_density_diffrn    4.393
_cod_database_code               9010874
_amcsd_formula_title             Ca4Ge4O12
Monte Carlo simulation of mixing in Ca3Fe2Ge3O12-Ca4Ge4O12 garnets and implications for the thermodynamic stability of pyrope-majorite solid solution Sample: SLEC
Vinograd, V. L.; Winkler, B.; Wilson, D. J.; Putnis, A.; Gale, J. D.; Physics and Chemistry of Minerals 33 (2006) 533–544; doi:10.1007/s00269-006-0099-5

data_9010875
_publ_section_title
;Monte Carlo simulation of mixing in Ca3Fe2Ge3O12-Ca4Ge4O12 garnets and
 implications for the thermodynamic stability of pyrope-majorite solid
 solution Sample: SLEC
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              533
_journal_page_last               544
_journal_paper_doi               10.1007/s00269-006-0099-5
_journal_volume                  33
_journal_year                    2006
_chemical_formula_structural     Ca4Ge4O12
_chemical_formula_sum            'Ca Ge O3'
_symmetry_space_group_name_H-M   'I 41/a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   12.539
_cell_length_b                   12.539
_cell_length_c                   12.34
_cell_formula_units_Z            32
_cell_volume                     1940.175
_database_code_amcsd             0009045
_exptl_crystal_density_diffrn    4.401
_cod_database_code               9010875
_amcsd_formula_title             Ca4Ge4O12
Monte Carlo simulation of mixing in Ca3Fe2Ge3O12-Ca4Ge4O12 garnets and implications for the thermodynamic stability of pyrope-majorite solid solution Sample: DFT
Vinograd, V. L.; Winkler, B.; Wilson, D. J.; Putnis, A.; Gale, J. D.; Physics and Chemistry of Minerals 33 (2006) 533–544; doi:10.1007/s00269-006-0099-5

data_9010876
_publ_section_title
;Monte Carlo simulation of mixing in Ca3Fe2Ge3O12-Ca4Ge4O12 garnets and
 implications for the thermodynamic stability of pyrope-majorite solid
 solution Sample: DFT
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              533
_journal_page_last               544
_journal_paper_doi               10.1007/s00269-006-0099-5
_journal_volume                  33
_journal_year                    2006
_chemical_formula_structural     Ca4Ge4O12
_chemical_formula_sum            'Ca Ge O3'
_symmetry_space_group_name_H-M   'I 41/a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   12.679
_cell_length_b                   12.679
_cell_length_c                   12.527
_cell_formula_units_Z            32
_cell_volume                     2013.803
_database_code_amcsd             0009046
_exptl_crystal_density_diffrn    4.240
_cod_database_code               9010876
_amcsd_formula_title             Ca4Ge4O12
Single-crystal elastic properties of alunite, KAl3(SO4)2(OH)6
Majzlan, J.; Speziale, S.; Duffy, T. S.; Burns, P. C.; Physics and Chemistry of Minerals 33 (2006) 567–573; doi:10.1007/s00269-006-0104-z

data_9010877
_publ_section_title
;
 Single-crystal elastic properties of alunite, KAl3(SO4)2(OH)6
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              567
_journal_page_last               573
_journal_paper_doi               10.1007/s00269-006-0104-z
_journal_volume                  33
_journal_year                    2006
_chemical_formula_sum            'Al2.967 H6 K0.805 Na0.132 O14.063 S2'
_chemical_name_mineral           Alunite
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   6.9741
_cell_length_b                   6.9741
_cell_length_c                   17.190
_cell_formula_units_Z            3
_cell_volume                     724.074
_database_code_amcsd             0009047
_exptl_crystal_density_diffrn    2.819
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'S2 Al2.967 O14.063 K.805 Na.132 H6'
_cod_database_code               9010877
In situ time resolved synchrotron powder diffraction study of thaumasite Sample: T = 303 K
Martucci, A.; Cruciani, G.; Physics and Chemistry of Minerals 33 (2006) 723–731; doi:10.1007/s00269-006-0124-8

data_9010878
_publ_section_title
;
 In situ time resolved synchrotron powder diffraction study of thaumasite
 Sample: T = 303 K
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              723
_journal_page_last               731
_journal_paper_doi               10.1007/s00269-006-0124-8
_journal_volume                  33
_journal_year                    2006
_chemical_formula_sum            'C H30 Ca3 O25 S Si'
_chemical_name_mineral           Thaumasite
_space_group_IT_number           173
_symmetry_space_group_name_Hall  'P 6c'
_symmetry_space_group_name_H-M   'P 63'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   11.0575
_cell_length_b                   11.0575
_cell_length_c                   10.4163
_cell_volume                     1102.956
_database_code_amcsd             0009048
_diffrn_ambient_temperature      303
_exptl_crystal_density_diffrn    1.838
_cod_original_cell_volume        1102.955
_cod_original_formula_sum        'Ca3 Si C S O25 H30'
_cod_database_code               9010878
In situ time resolved synchrotron powder diffraction study of thaumasite Sample: T = 413 K
Martucci, A.; Cruciani, G.; Physics and Chemistry of Minerals 33 (2006) 723–731; doi:10.1007/s00269-006-0124-8

data_9010879
_publ_section_title
;
 In situ time resolved synchrotron powder diffraction study of thaumasite
 Sample: T = 413    K
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              723
_journal_page_last               731
_journal_paper_doi               10.1007/s00269-006-0124-8
_journal_volume                  33
_journal_year                    2006
_chemical_formula_sum            'C H18 Ca3 O24.67 S Si'
_chemical_name_mineral           Thaumasite
_space_group_IT_number           173
_symmetry_space_group_name_Hall  'P 6c'
_symmetry_space_group_name_H-M   'P 63'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   11.0825
_cell_length_b                   11.0825
_cell_length_c                   10.4447
_cell_volume                     1110.969
_database_code_amcsd             0009049
_diffrn_ambient_temperature      413
_exptl_crystal_density_diffrn    1.809
_cod_original_formula_sum        'Ca3 Si C S O24.67 H18'
_cod_database_code               9010879
Behavior of 10-A phase at low temperatures Sample: T = 293 K
Zanazzi, P. F.; Comodi, P.; Nazzareni, S.; Rotiroti, N.; van Smaalen, S.; Physics and Chemistry of Minerals 34 (2007) 23–29; doi:10.1007/s00269-006-0123-9

data_9010880
_publ_section_title
;
 Behavior of 10-A phase at low temperatures
 Sample: T = 293 K
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              23
_journal_page_last               29
_journal_paper_doi               10.1007/s00269-006-0123-9
_journal_volume                  34
_journal_year                    2007
_chemical_formula_structural     Mg3Si4O10(OH)2*H2O
_chemical_formula_sum            'H5.92 Mg3 O13 Si4'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 99.97
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.3007
_cell_length_b                   9.186
_cell_length_c                   10.185
_cell_volume                     488.441
_database_code_amcsd             0009050
_diffrn_ambient_temperature      293
_exptl_crystal_density_diffrn    2.714
_cod_original_formula_sum        'Si4 Mg3 O13 H5.92'
_cod_database_code               9010880
_amcsd_formula_title             Mg3Si4O10(OH)2*H2O
Behavior of 10-A phase at low temperatures Sample: T = 116 K
Zanazzi, P. F.; Comodi, P.; Nazzareni, S.; Rotiroti, N.; van Smaalen, S.; Physics and Chemistry of Minerals 34 (2007) 23–29; doi:10.1007/s00269-006-0123-9

data_9010881
_publ_section_title
;
 Behavior of 10-A phase at low temperatures
 Sample: T = 116 K
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              23
_journal_page_last               29
_journal_paper_doi               10.1007/s00269-006-0123-9
_journal_volume                  34
_journal_year                    2007
_chemical_formula_structural     Mg3Si4O10(OH)2*H2O
_chemical_formula_sum            'H5.92 Mg3 O13 Si4'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.05
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.3000
_cell_length_b                   9.182
_cell_length_c                   10.096
_cell_volume                     483.779
_database_code_amcsd             0009051
_diffrn_ambient_temperature      116
_exptl_crystal_density_diffrn    2.741
_cod_original_formula_sum        'Si4 Mg3 O13 H5.92'
_cod_database_code               9010881
_amcsd_formula_title             Mg3Si4O10(OH)2*H2O
High-pressure properties of diaspore, AlO(OH) Sample: p = 2.0 GPa
Friedrich, A.; Wilson, D. J.; Haussuhl, E.; Winkler, B.; Morgenroth, W.; Refson, K.; Milman, V.; Physics and Chemistry of Minerals 34 (2007) 145–157; doi:10.1007/s00269-006-0135-5

data_9010882
_publ_section_title
;
 High-pressure properties of diaspore, AlO(OH)
 Sample: p = 2.0 GPa
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              145
_journal_page_last               157
_journal_paper_doi               10.1007/s00269-006-0135-5
_journal_volume                  34
_journal_year                    2007
_chemical_formula_sum            'Al H O2'
_chemical_name_mineral           Diaspore
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.374
_cell_length_b                   9.39
_cell_length_c                   2.833
_cell_formula_units_Z            4
_cell_volume                     116.357
_database_code_amcsd             0009052
_exptl_crystal_density_diffrn    3.424
_cod_original_formula_sum        'Al O2 H'
_cod_database_code               9010882
High-pressure properties of diaspore, AlO(OH) Sample: p = 3.41 GPa
Friedrich, A.; Wilson, D. J.; Haussuhl, E.; Winkler, B.; Morgenroth, W.; Refson, K.; Milman, V.; Physics and Chemistry of Minerals 34 (2007) 145–157; doi:10.1007/s00269-006-0135-5

data_9010883
_publ_section_title
;
 High-pressure properties of diaspore, AlO(OH)
 Sample: p = 3.41 GPa
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              145
_journal_page_last               157
_journal_paper_doi               10.1007/s00269-006-0135-5
_journal_volume                  34
_journal_year                    2007
_chemical_formula_sum            'Al H O2'
_chemical_name_mineral           Diaspore
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.354
_cell_length_b                   9.369
_cell_length_c                   2.8281
_cell_formula_units_Z            4
_cell_volume                     115.366
_database_code_amcsd             0009053
_exptl_crystal_density_diffrn    3.454
_cod_original_formula_sum        'Al O2 H'
_cod_database_code               9010883
High-pressure properties of diaspore, AlO(OH) Sample: p = 4.89 GPa
Friedrich, A.; Wilson, D. J.; Haussuhl, E.; Winkler, B.; Morgenroth, W.; Refson, K.; Milman, V.; Physics and Chemistry of Minerals 34 (2007) 145–157; doi:10.1007/s00269-006-0135-5

data_9010884
_publ_section_title
;
 High-pressure properties of diaspore, AlO(OH)
 Sample: p = 4.89 GPa
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              145
_journal_page_last               157
_journal_paper_doi               10.1007/s00269-006-0135-5
_journal_volume                  34
_journal_year                    2007
_chemical_formula_sum            'Al H O2'
_chemical_name_mineral           Diaspore
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.335
_cell_length_b                   9.34
_cell_length_c                   2.820
_cell_formula_units_Z            4
_cell_volume                     114.179
_database_code_amcsd             0009054
_exptl_crystal_density_diffrn    3.490
_cod_original_formula_sum        'Al O2 H'
_cod_database_code               9010884