LMucko/crystallography-open-database huggingface dataset:
Looking for jarosite on Mars: The low-temperature crystal structure of jarosite
Mills, S.J.; Nestola, F.; Kahlenberg, V.; Christy, A.G.; Hejny, C.; Redhammer, G.J.; American Mineralogist 98 (2013) 1966–1971; doi:10.2138/am.2013.4587

data_1557932
_publ_section_title
;
 Looking for jarosite on Mars: The low-temperature crystal structure of
 jarosite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1966
_journal_page_last               1971
_journal_paper_doi               10.2138/am.2013.4587
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'F3 H6 K O14 S2'
_chemical_name_common            KFe(SO4)2(OH)2'
_chemical_name_mineral           'jarosite at 253 K'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   7.2931(3)
_cell_length_b                   7.2931(3)
_cell_length_c                   17.1456(10)
_cell_volume                     789.78(7)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      253
_cod_data_source_file            jarosite-253K.cif
_cod_data_source_block           jarosite-253K
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'K F3 S2 O14 H6'
_cod_database_code               1557932
Looking for jarosite on Mars: The low-temperature crystal structure of jarosite
Mills, S.J.; Nestola, F.; Kahlenberg, V.; Christy, A.G.; Hejny, C.; Redhammer, G.J.; American Mineralogist 98 (2013) 1966–1971; doi:10.2138/am.2013.4587

data_1557933
_publ_section_title
;
 Looking for jarosite on Mars: The low-temperature crystal structure of
 jarosite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1966
_journal_page_last               1971
_journal_paper_doi               10.2138/am.2013.4587
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'F3 H6 K O14 S2'
_chemical_name_common            KFe(SO4)2(OH)2'
_chemical_name_mineral           'jarosite at 213 K'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   7.2918(3)
_cell_length_b                   7.2918(3)
_cell_length_c                   17.1235(9)
_cell_volume                     788.48(6)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      213
_cod_data_source_file            jarosite-213K.cif
_cod_data_source_block           jarosite-213K
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'K F3 S2 O14 H6'
_cod_database_code               1557933
Looking for jarosite on Mars: The low-temperature crystal structure of jarosite
Mills, S.J.; Nestola, F.; Kahlenberg, V.; Christy, A.G.; Hejny, C.; Redhammer, G.J.; American Mineralogist 98 (2013) 1966–1971; doi:10.2138/am.2013.4587

data_1557934
_publ_section_title
;
 Looking for jarosite on Mars: The low-temperature crystal structure of
 jarosite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1966
_journal_page_last               1971
_journal_paper_doi               10.2138/am.2013.4587
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'F3 H6 K O14 S2'
_chemical_name_common            KFe(SO4)2(OH)2'
_chemical_name_mineral           'jarosite at 173 K'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   7.2918(3)
_cell_length_b                   7.2918(3)
_cell_length_c                   17.1026(10)
_cell_volume                     787.52(6)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      173
_cod_data_source_file            jarosite-173K.cif
_cod_data_source_block           jarosite-173K
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'K F3 S2 O14 H6'
_cod_database_code               1557934
Looking for jarosite on Mars: The low-temperature crystal structure of jarosite
Mills, S.J.; Nestola, F.; Kahlenberg, V.; Christy, A.G.; Hejny, C.; Redhammer, G.J.; American Mineralogist 98 (2013) 1966–1971; doi:10.2138/am.2013.4587

data_1557935
_publ_section_title
;
 Looking for jarosite on Mars: The low-temperature crystal structure of
 jarosite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1966
_journal_page_last               1971
_journal_paper_doi               10.2138/am.2013.4587
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'F3 H6 K O14 S2'
_chemical_name_common            KFe(SO4)2(OH)2'
_chemical_name_mineral           'jarosite at 133 K'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   7.2907(3)
_cell_length_b                   7.2907(3)
_cell_length_c                   17.0900(8)
_cell_volume                     786.70(6)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      133
_cod_data_source_file            jarosite-133K.cif
_cod_data_source_block           jarosite-133K
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'K F3 S2 O14 H6'
_cod_database_code               1557935
New morphological, chemical, and structural data of wooly erionite-Na from Durkee, Oregon, U.S.A.
Cametti, G.; Pacella, A.; Mura, F.; Rossi, M.; Ballirano, P.; American Mineralogist 98 (2013) 2155–2163; doi:10.2138/am.2013.4474

data_1557936
_publ_section_title
;
 New morphological, chemical, and structural data of wooly erionite-Na
 from Durkee, Oregon, U.S.A.
;
_journal_name_full               'American Mineralogist'
_journal_page_first              2155
_journal_page_last               2163
_journal_paper_doi               10.2138/am.2013.4474
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum
'Al7.66 H59.66 K1.99 Mg0.24 Na5.38 O101.92 Si28.34'
_chemical_name_common
(Na5.38K1.99Mg0.24)[Al7.66Si28.34O72.09]29.83H2O
_chemical_name_mineral           erionite-Na
_space_group_IT_number           194
_space_group_name_Hall           '-P 6c 2c'
_space_group_name_H-M_alt        'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   13.2357(5)
_cell_length_b                   13.2357(5)
_cell_length_c                   15.0652(6)
_cell_volume                     2285.60(15)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      298
_cod_data_source_file            erionite-Na.cif
_cod_data_source_block           erionite-Na
_cod_original_formula_sum
'Na5.38 K1.99 Mg0.24 Al7.66 Si28.34 O101.92 H59.66'
_cod_database_code               1557936
Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure
Wadoski-Romeijn, E.; Armbruster, T.; American Mineralogist 98 (2013) 1988–1997; doi:10.2138/am.2013.4495

data_1557939
_publ_section_title
;
 Topotactic transformation and dehydration of the zeolite gismondine to a
 novel Ca feldspar structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1988
_journal_page_last               1997
_journal_paper_doi               10.2138/am.2013.4495
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al8 Ca4 H36 O50 Si8'
_chemical_name_common            Ca4(Al8Si8O32)18H2O
_chemical_name_mineral           gismondine
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 92.363(1)
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   10.0214(1)
_cell_length_b                   10.5997(1)
_cell_length_c                   9.8327(1)
_cell_volume                     1043.579(18)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      298
_cod_data_source_file            gismondine-RT.cif
_cod_data_source_block           gismondine-RT
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'Ca4 Al8 Si8 O50 H36'
_cod_database_code               1557939
Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure
Wadoski-Romeijn, E.; Armbruster, T.; American Mineralogist 98 (2013) 1988–1997; doi:10.2138/am.2013.4495

data_1557940
_publ_section_title
;
 Topotactic transformation and dehydration of the zeolite gismondine to a
 novel Ca feldspar structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1988
_journal_page_last               1997
_journal_paper_doi               10.2138/am.2013.4495
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al8 Ca4 H36 O50 Si8'
_chemical_name_common            Ca4(Al8Si8O32)18H2O
_chemical_name_mineral           'gismondine at 75 C'
_space_group_IT_number           15
_space_group_name_Hall           '-I 2ya'
_space_group_name_H-M_alt        'I 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.97(3)
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   9.790(2)
_cell_length_b                   10.437(2)
_cell_length_c                   9.790(2)
_cell_volume                     1000.2(3)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      348
_cod_data_source_file            gismondine-I2a-75C.cif
_cod_data_source_block           gismondine-75C
_cod_original_sg_symbol_H-M      'I 2/a'
_cod_original_formula_sum        'Ca4 Al8 Si8 O50 H36'
_cod_database_code               1557940
Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure
Wadoski-Romeijn, E.; Armbruster, T.; American Mineralogist 98 (2013) 1988–1997; doi:10.2138/am.2013.4495

data_1557941
_publ_section_title
;
 Topotactic transformation and dehydration of the zeolite gismondine to a
 novel Ca feldspar structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1988
_journal_page_last               1997
_journal_paper_doi               10.2138/am.2013.4495
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al8 Ca4 H36 O50 Si8'
_chemical_name_common            Ca4(Al8Si8O32)18H2O
_chemical_name_mineral           'gismondine C2/c at 225 C'
_space_group_IT_number           15
_space_group_name_Hall           '-I 2ya'
_space_group_name_H-M_alt        'I 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 89.04(1)
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   9.434(4)
_cell_length_b                   9.044(2)
_cell_length_c                   9.695(2)
_cell_volume                     827.1(4)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      498
_cod_data_source_file            gismondine-C2c-225C.cif
_cod_data_source_block           gismondine-225C
_cod_original_sg_symbol_H-M      'I 2/a'
_cod_original_formula_sum        'Ca4 Al8 Si8 O50 H36'
_cod_database_code               1557941
Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure
Wadoski-Romeijn, E.; Armbruster, T.; American Mineralogist 98 (2013) 1988–1997; doi:10.2138/am.2013.4495

data_1557942
_publ_section_title
;
 Topotactic transformation and dehydration of the zeolite gismondine to a
 novel Ca feldspar structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1988
_journal_page_last               1997
_journal_paper_doi               10.2138/am.2013.4495
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al2 Ca O8 Si2'
_chemical_name_common            CaAl2Si2O8
_chemical_name_mineral           'Ca feldspar at 350 C'
_space_group_IT_number           2
_space_group_name_Hall           '-C 1'
_space_group_name_H-M_alt        'C -1'
_cell_angle_alpha                93.26(3)
_cell_angle_beta                 116.37(6)
_cell_angle_gamma                88.72(5)
_cell_formula_units_Z            1
_cell_length_a                   8.152(5)
_cell_length_b                   12.917(5)
_cell_length_c                   7.126(4)
_cell_volume                     671.2(7)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      623
_cod_data_source_file            Ca-feldspar-350C.cif
_cod_data_source_block           Ca-feldspar-350C
_cod_original_formula_sum        'Ca1 Al2 Si2 O8'
_cod_database_code               1557942
A new framework topology in the dehydrated form of zeolite levyne
Arletti, R.; Vezzalini, G.; Quartieri, S.; Camara, F.; Alvaro, M.; American Mineralogist 98 (2013) 2063–2074; doi:10.2138/am.2013.4583

data_1557945
_publ_section_title
;
 A new framework topology in the dehydrated form of zeolite levyne
;
_journal_name_full               'American Mineralogist'
_journal_page_first              2063
_journal_page_last               2074
_journal_paper_doi               10.2138/am.2013.4583
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al20 Ca7.8 H103 K1.1 Na2.2 O159.5 Si34.2'
_chemical_name_common            (Ca7.8Na2.2K1.1)(Al20Si34.2O108)51.5H2O
_chemical_name_mineral           'levyne SR data at 458 C'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   12.7730(7)
_cell_length_b                   12.7730(7)
_cell_length_c                   23.566(1)
_cell_volume                     3329.7(3)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      731
_cod_data_source_file            levyne-458C-SR.cif
_cod_data_source_block           levyne-458C-SR
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Ca7.8 Na2.2 K1.1 Al20 Si34.2 O159.5 H103'
_cod_database_code               1557945
A new framework topology in the dehydrated form of zeolite levyne
Arletti, R.; Vezzalini, G.; Quartieri, S.; Camara, F.; Alvaro, M.; American Mineralogist 98 (2013) 2063–2074; doi:10.2138/am.2013.4583

data_1557946
_publ_section_title
;
 A new framework topology in the dehydrated form of zeolite levyne
;
_journal_name_full               'American Mineralogist'
_journal_page_first              2063
_journal_page_last               2074
_journal_paper_doi               10.2138/am.2013.4583
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al20 Ca7.8 H103 K1.1 Na2.2 O159.5 Si34.2'
_chemical_name_common            (Ca7.8Na2.2K1.1)(Al20Si34.2O108)51.5H2O
_chemical_name_mineral           'levyne SR data at 266 C'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   13.2213(3)
_cell_length_b                   13.2213(3)
_cell_length_c                   23.1860(9)
_cell_volume                     3509.98(18)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      539
_cod_data_source_file            levyne-266C-SR.cif
_cod_data_source_block           levyne-266C-SR
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Ca7.8 Na2.2 K1.1 Al20 Si34.2 O159.5 H103'
_cod_database_code               1557946
A new framework topology in the dehydrated form of zeolite levyne
Arletti, R.; Vezzalini, G.; Quartieri, S.; Camara, F.; Alvaro, M.; American Mineralogist 98 (2013) 2063–2074; doi:10.2138/am.2013.4583

data_1557947
_publ_section_title
;
 A new framework topology in the dehydrated form of zeolite levyne
;
_journal_name_full               'American Mineralogist'
_journal_page_first              2063
_journal_page_last               2074
_journal_paper_doi               10.2138/am.2013.4583
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al20 Ca7.8 H103 K1.1 Na2.2 O159.5 Si34.2'
_chemical_name_common            (Ca7.8Na2.2K1.1)(Al20Si34.2O108)51.5H2O
_chemical_name_mineral           'levyne single crystal data at 100 C'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   13.3690(8)
_cell_length_b                   13.3690(8)
_cell_length_c                   22.760(3)
_cell_volume                     3522.9(6)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      373
_cod_data_source_file            levyne-100C.cif
_cod_data_source_block           levyne-100C-SC
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Ca7.8 Na2.2 K1.1 Al20 Si34.2 O159.5 H103'
_cod_database_code               1557947
A new framework topology in the dehydrated form of zeolite levyne
Arletti, R.; Vezzalini, G.; Quartieri, S.; Camara, F.; Alvaro, M.; American Mineralogist 98 (2013) 2063–2074; doi:10.2138/am.2013.4583

data_1557948
_publ_section_title
;
 A new framework topology in the dehydrated form of zeolite levyne
;
_journal_name_full               'American Mineralogist'
_journal_page_first              2063
_journal_page_last               2074
_journal_paper_doi               10.2138/am.2013.4583
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al20 Ca7.8 H103 K1.1 Na2.2 O159.5 Si34.2'
_chemical_name_common            (Ca7.8Na2.2K1.1)(Al20Si34.2O108)51.5H2O
_chemical_name_mineral           'levyne single crystal data'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   13.421(3)
_cell_length_b                   13.421(3)
_cell_length_c                   22.762(12)
_cell_volume                     3551(2)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      298
_cod_data_source_file            levyne-RT.cif
_cod_data_source_block           levyne-RT-SC
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Ca7.8 Na2.2 K1.1 Al20 Si34.2 O159.5 H103'
_cod_database_code               1557948
A new framework topology in the dehydrated form of zeolite levyne
Arletti, R.; Vezzalini, G.; Quartieri, S.; Camara, F.; Alvaro, M.; American Mineralogist 98 (2013) 2063–2074; doi:10.2138/am.2013.4583

data_1557949
_publ_section_title
;
 A new framework topology in the dehydrated form of zeolite levyne
;
_journal_name_full               'American Mineralogist'
_journal_page_first              2063
_journal_page_last               2074
_journal_paper_doi               10.2138/am.2013.4583
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al20 Ca7.8 H103 K1.1 Na2.2 O159.5 Si34.2'
_chemical_name_common            (Ca7.8Na2.2K1.1)(Al20Si34.2O108)51.5H2O
_chemical_name_mineral           'levyne single crystal data (dehydrated)'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   12.8585(7)
_cell_length_b                   12.8585(7)
_cell_length_c                   23.419(3)
_cell_volume                     3353.4(5)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      298
_cod_data_source_file            levyne-RT-rev.cif
_cod_data_source_block           levyne-RT-rev-SC
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Ca7.8 Na2.2 K1.1 Al20 Si34.2 O159.5 H103'
_cod_database_code               1557949
A new framework topology in the dehydrated form of zeolite levyne
Arletti, R.; Vezzalini, G.; Quartieri, S.; Camara, F.; Alvaro, M.; American Mineralogist 98 (2013) 2063–2074; doi:10.2138/am.2013.4583

data_1557950
_publ_section_title
;
 A new framework topology in the dehydrated form of zeolite levyne
;
_journal_name_full               'American Mineralogist'
_journal_page_first              2063
_journal_page_last               2074
_journal_paper_doi               10.2138/am.2013.4583
_journal_volume                  98
_journal_year                    2013
_chemical_formula_sum            'Al20 Ca7.8 H103 K1.1 Na2.2 O159.5 Si34.2'
_chemical_name_common            (Ca7.8Na2.2K1.1)(Al20Si34.2O108)51.5H2O
_chemical_name_mineral           'levyne SR data'
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   13.3769(4)
_cell_length_b                   13.3769(4)
_cell_length_c                   22.869(1)
_cell_volume                     3544.0(2)
_diffrn_ambient_pressure         100
_diffrn_ambient_temperature      298
_cod_data_source_file            levyne-RT-SR.cif
_cod_data_source_block           levyne-RT-SR
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Ca7.8 Na2.2 K1.1 Al20 Si34.2 O159.5 H103'
_cod_database_code               1557950