LMucko/crystallography-open-database huggingface dataset:
Crystal chemistry of some Fe- and Ti-poor dumortierites Sample: #7, BYU 12-5119, from Virgin Mtns., Nevada, USA O5y and O11x have been editted
Alexander, V. D.; Griffen, D. T.; Martin, T. J.; American Mineralogist 71 (1986) 786–794; doi:

data_9001001
_publ_section_title
;
 Crystal chemistry of some Fe- and Ti-poor dumortierites
 Sample: #7, BYU 12-5119, from Virgin Mtns., Nevada, USA
 O5y and O11x have been editted
;
_journal_name_full               'American Mineralogist'
_journal_page_first              786
_journal_page_last               794
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Al6.84 B O18 Si3'
_chemical_name_mineral           Dumortierite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2n 2a'
_symmetry_space_group_name_H-M   'P m c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   11.798
_cell_length_b                   20.210
_cell_length_c                   4.710
_cell_formula_units_Z            4
_cell_volume                     1123.041
_database_code_amcsd             0001023
_exptl_crystal_density_diffrn    3.357
_cod_original_formula_sum        'Si3 Al6.84 B O18'
_cod_database_code               9001001
Crystal chemistry of some Fe- and Ti-poor dumortierites Sample: #10, USNM 96698, from Petaca, New Mexco, USA
Alexander, V. D.; Griffen, D. T.; Martin, T. J.; American Mineralogist 71 (1986) 786–794; doi:

data_9001002
_publ_section_title
;
 Crystal chemistry of some Fe- and Ti-poor dumortierites
 Sample: #10, USNM 96698, from Petaca, New Mexco, USA
;
_journal_name_full               'American Mineralogist'
_journal_page_first              786
_journal_page_last               794
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Al6.81 B0.98 O18 Si2.98'
_chemical_name_mineral           Dumortierite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2n 2a'
_symmetry_space_group_name_H-M   'P m c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   11.800
_cell_length_b                   20.222
_cell_length_c                   4.699
_cell_formula_units_Z            4
_cell_volume                     1121.274
_database_code_amcsd             0001024
_exptl_crystal_density_diffrn    3.353
_cod_original_formula_sum        'Si2.98 Al6.81 B.98 O18'
_cod_database_code               9001002
Crystal chemistry of some Fe- and Ti-poor dumortierites Sample: #11, USNM 141800, from Ambositra, Madagascar
Alexander, V. D.; Griffen, D. T.; Martin, T. J.; American Mineralogist 71 (1986) 786–794; doi:

data_9001003
_publ_section_title
;
 Crystal chemistry of some Fe- and Ti-poor dumortierites
 Sample: #11, USNM 141800, from Ambositra, Madagascar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              786
_journal_page_last               794
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Al6.73 B O18 Si2.95'
_chemical_name_mineral           Dumortierite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2n 2a'
_symmetry_space_group_name_H-M   'P m c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   11.802
_cell_length_b                   20.222
_cell_length_c                   4.695
_cell_formula_units_Z            4
_cell_volume                     1120.509
_database_code_amcsd             0001025
_exptl_crystal_density_diffrn    3.339
_cod_original_formula_sum        'Si2.95 Al6.73 B O18'
_cod_database_code               9001003
High-temperature crystal chemistry of dolomite Sample: Anisotropic refinement, Temperature = 24 deg C
Reeder, R. J.; Markgraf, S. A.; American Mineralogist 71 (1986) 795–804; doi:

data_9001004
_publ_section_title
;
 High-temperature crystal chemistry of dolomite
 Sample: Anisotropic refinement, Temperature = 24 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              795
_journal_page_last               804
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'C2 Ca Mg O6'
_chemical_name_mineral           Dolomite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.8069
_cell_length_b                   4.8069
_cell_length_c                   16.002
_cell_formula_units_Z            3
_cell_volume                     320.210
_database_code_amcsd             0001026
_diffrn_ambient_temperature      297.15
_exptl_crystal_density_diffrn    2.869
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Ca Mg C2 O6'
_cod_database_code               9001004
High-temperature crystal chemistry of dolomite Sample: Anisotropic refinement, Temperature = 200 deg C
Reeder, R. J.; Markgraf, S. A.; American Mineralogist 71 (1986) 795–804; doi:

data_9001005
_publ_section_title
;
 High-temperature crystal chemistry of dolomite
 Sample: Anisotropic refinement, Temperature = 200 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              795
_journal_page_last               804
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'C2 Ca Mg O6'
_chemical_name_mineral           Dolomite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.8104
_cell_length_b                   4.8104
_cell_length_c                   16.055
_cell_formula_units_Z            3
_cell_volume                     321.739
_database_code_amcsd             0001027
_diffrn_ambient_temperature      473.15
_exptl_crystal_density_diffrn    2.855
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Ca Mg C2 O6'
_cod_database_code               9001005
High-temperature crystal chemistry of dolomite Sample: Anisotropic refinement, Temperature = 400 deg C
Reeder, R. J.; Markgraf, S. A.; American Mineralogist 71 (1986) 795–804; doi:

data_9001006
_publ_section_title
;
 High-temperature crystal chemistry of dolomite
 Sample: Anisotropic refinement, Temperature = 400 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              795
_journal_page_last               804
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'C2 Ca Mg O6'
_chemical_name_mineral           Dolomite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.8162
_cell_length_b                   4.8162
_cell_length_c                   16.132
_cell_formula_units_Z            3
_cell_volume                     324.062
_database_code_amcsd             0001028
_diffrn_ambient_temperature      673.15
_exptl_crystal_density_diffrn    2.835
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Ca Mg C2 O6'
_cod_database_code               9001006
High-temperature crystal chemistry of dolomite Sample: Anisotropic refinement, Temperature = 600 deg C
Reeder, R. J.; Markgraf, S. A.; American Mineralogist 71 (1986) 795–804; doi:

data_9001007
_publ_section_title
;
 High-temperature crystal chemistry of dolomite
 Sample: Anisotropic refinement, Temperature = 600 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              795
_journal_page_last               804
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'C2 Ca Mg O6'
_chemical_name_mineral           Dolomite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.8228
_cell_length_b                   4.8228
_cell_length_c                   16.227
_cell_formula_units_Z            3
_cell_volume                     326.864
_database_code_amcsd             0001029
_diffrn_ambient_temperature      873.15
_exptl_crystal_density_diffrn    2.810
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Ca Mg C2 O6'
_cod_database_code               9001007
High-temperature crystal chemistry of dolomite Sample: Rigid-body refinement, Temperature = 24 deg C
Reeder, R. J.; Markgraf, S. A.; American Mineralogist 71 (1986) 795–804; doi:

data_9001008
_publ_section_title
;
 High-temperature crystal chemistry of dolomite
 Sample: Rigid-body refinement, Temperature = 24 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              795
_journal_page_last               804
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'C2 Ca Mg O6'
_chemical_name_mineral           Dolomite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.8069
_cell_length_b                   4.8069
_cell_length_c                   16.002
_cell_formula_units_Z            3
_cell_volume                     320.210
_database_code_amcsd             0001030
_diffrn_ambient_temperature      297.15
_exptl_crystal_density_diffrn    2.869
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Ca Mg C2 O6'
_cod_database_code               9001008
High-temperature crystal chemistry of dolomite Sample: Rigid-body refinement, Temperature = 200 deg C
Reeder, R. J.; Markgraf, S. A.; American Mineralogist 71 (1986) 795–804; doi:

data_9001009
_publ_section_title
;
 High-temperature crystal chemistry of dolomite
 Sample: Rigid-body refinement, Temperature = 200 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              795
_journal_page_last               804
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'C2 Ca Mg O6'
_chemical_name_mineral           Dolomite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.8104
_cell_length_b                   4.8104
_cell_length_c                   16.055
_cell_formula_units_Z            3
_cell_volume                     321.739
_database_code_amcsd             0001031
_diffrn_ambient_temperature      473.15
_exptl_crystal_density_diffrn    2.855
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Ca Mg C2 O6'
_cod_database_code               9001009
High-temperature crystal chemistry of dolomite Sample: Rigid-body refinement, Temperature = 400 deg C
Reeder, R. J.; Markgraf, S. A.; American Mineralogist 71 (1986) 795–804; doi:

data_9001010
_publ_section_title
;
 High-temperature crystal chemistry of dolomite
 Sample: Rigid-body refinement, Temperature = 400 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              795
_journal_page_last               804
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'C2 Ca Mg O6'
_chemical_name_mineral           Dolomite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.8162
_cell_length_b                   4.8162
_cell_length_c                   16.132
_cell_formula_units_Z            3
_cell_volume                     324.062
_database_code_amcsd             0001032
_diffrn_ambient_temperature      673.15
_exptl_crystal_density_diffrn    2.835
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Ca Mg C2 O6'
_cod_database_code               9001010
High-temperature crystal chemistry of dolomite Sample: Rigid-body refinement, Temperature = 600 deg C
Reeder, R. J.; Markgraf, S. A.; American Mineralogist 71 (1986) 795–804; doi:

data_9001011
_publ_section_title
;
 High-temperature crystal chemistry of dolomite
 Sample: Rigid-body refinement, Temperature = 600 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              795
_journal_page_last               804
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'C2 Ca Mg O6'
_chemical_name_mineral           Dolomite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.8228
_cell_length_b                   4.8228
_cell_length_c                   16.227
_cell_formula_units_Z            3
_cell_volume                     326.864
_database_code_amcsd             0001033
_diffrn_ambient_temperature      873.15
_exptl_crystal_density_diffrn    2.810
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Ca Mg C2 O6'
_cod_database_code               9001011
Structure refinement of calzirtite from Jacupiranga, Brazil
Sinclair, W.; Eggleton, R. A.; McLaughlin, G. M.; American Mineralogist 71 (1986) 815–818; doi:

data_9001012
_publ_section_title
;
 Structure refinement of calzirtite from Jacupiranga, Brazil
;
_journal_name_full               'American Mineralogist'
_journal_page_first              815
_journal_page_last               818
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Ca Fe0.1 Nb0.15 O8 Ti0.75 Zr2.5'
_chemical_name_mineral           Calzirtite
_space_group_IT_number           142
_symmetry_space_group_name_Hall  'I 4bw 2aw -1bw'
_symmetry_space_group_name_H-M   'I 41/a c d :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   15.094
_cell_length_b                   15.094
_cell_length_c                   10.043
_cell_formula_units_Z            16
_cell_volume                     2288.085
_database_code_amcsd             0001034
_exptl_crystal_density_diffrn    5.243
_cod_original_sg_symbol_H-M      'I 41/a c d'
_cod_original_formula_sum        'Zr2.5 (Ti.75 Fe.1 Nb.15) Ca O8'
_cod_database_code               9001012
Structure of ungemachite, K3Na8Fe(SO4)6(NO3)2.6H2O, a mixed sulfate-nitrate mineral Note U(1,2) for N and Na1 have been altered to match symmetry constraints.
Groat, L. A.; Hawthorne, F. C.; American Mineralogist 71 (1986) 826–829; doi:

data_9001013
_publ_section_title
;
 Structure of ungemachite, K3Na8Fe(SO4)6(NO3)2.6H2O, a mixed
 sulfate-nitrate mineral
 Note U(1,2) for N and Na1 have been altered to match symmetry constraints.
;
_journal_name_full               'American Mineralogist'
_journal_page_first              826
_journal_page_last               829
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Fe H12 K3 N2 Na8 O36 S6'
_chemical_name_mineral           Ungemachite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   10.898
_cell_length_b                   10.898
_cell_length_c                   24.989
_cell_formula_units_Z            3
_cell_volume                     2570.237
_database_code_amcsd             0001035
_exptl_crystal_density_diffrn    2.259
_cod_original_cell_volume        2570.236
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe S6 N2 K3 Na8 O36 H12'
_cod_database_code               9001013
High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase (BeAlSiO4OH) Sample: Pressure = .001 kbar
Hazen, R. M.; Au, A. Y.; Finger, L. W.; American Mineralogist 71 (1986) 977–984; doi:

data_9001014
_publ_section_title
;High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase
 (BeAlSiO4OH) Sample: Pressure = .001 kbar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              977
_journal_page_last               984
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Al Be H O5 Si'
_chemical_name_mineral           Euclase
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.310
_cell_angle_gamma                90
_cell_length_a                   4.780
_cell_length_b                   14.322
_cell_length_c                   4.6335
_cell_formula_units_Z            4
_cell_volume                     312.084
_database_code_amcsd             0001036
_diffrn_ambient_pressure         100
_exptl_crystal_density_diffrn    3.088
_cod_original_formula_sum        'Si Al Be O5 H'
_cod_database_code               9001014
High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase (BeAlSiO4OH) Sample: Pressure = 21 kbar
Hazen, R. M.; Au, A. Y.; Finger, L. W.; American Mineralogist 71 (1986) 977–984; doi:

data_9001015
_publ_section_title
;High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase
 (BeAlSiO4OH) Sample: Pressure = 21 kbar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              977
_journal_page_last               984
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Al Be O5 Si'
_chemical_name_mineral           Euclase
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.24
_cell_angle_gamma                90
_cell_length_a                   4.759
_cell_length_b                   14.255
_cell_length_c                   4.612
_cell_formula_units_Z            4
_cell_volume                     307.892
_database_code_amcsd             0001037
_diffrn_ambient_pressure         2.1e+06
_exptl_crystal_density_diffrn    3.108
_cod_original_formula_sum        'Si Al Be O5'
_cod_database_code               9001015
High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase (BeAlSiO4OH) Sample: Pressure = 42 kbar
Hazen, R. M.; Au, A. Y.; Finger, L. W.; American Mineralogist 71 (1986) 977–984; doi:

data_9001016
_publ_section_title
;High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase
 (BeAlSiO4OH) Sample: Pressure = 42 kbar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              977
_journal_page_last               984
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Al Be O5 Si'
_chemical_name_mineral           Euclase
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.18
_cell_angle_gamma                90
_cell_length_a                   4.746
_cell_length_b                   14.189
_cell_length_c                   4.599
_cell_formula_units_Z            4
_cell_volume                     304.826
_database_code_amcsd             0001038
_diffrn_ambient_pressure         4.2e+06
_exptl_crystal_density_diffrn    3.139
_cod_original_formula_sum        'Si Al Be O5'
_cod_database_code               9001016
High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase (BeAlSiO4OH) Sample: Pressure = 62 kbar
Hazen, R. M.; Au, A. Y.; Finger, L. W.; American Mineralogist 71 (1986) 977–984; doi:

data_9001017
_publ_section_title
;High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase
 (BeAlSiO4OH) Sample: Pressure = 62 kbar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              977
_journal_page_last               984
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Al Be O5 Si'
_chemical_name_mineral           Euclase
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.16
_cell_angle_gamma                90
_cell_length_a                   4.730
_cell_length_b                   14.136
_cell_length_c                   4.580
_cell_formula_units_Z            4
_cell_volume                     301.432
_database_code_amcsd             0001039
_diffrn_ambient_pressure         6.2e+06
_exptl_crystal_density_diffrn    3.175
_cod_original_formula_sum        'Si Al Be O5'
_cod_database_code               9001017
High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase (BeAlSiO4OH) Sample: Pressure = .001 kbar
Hazen, R. M.; Au, A. Y.; Finger, L. W.; American Mineralogist 71 (1986) 977–984; doi:

data_9001018
_publ_section_title
;High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase
 (BeAlSiO4OH) Sample: Pressure = .001 kbar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              977
_journal_page_last               984
_journal_volume                  71
_journal_year                    1986
_chemical_formula_sum            'Al2 Be3 O18 Si6'
_chemical_name_mineral           Beryl
_space_group_IT_number           192
_symmetry_space_group_name_Hall  '-P 6 2c'
_symmetry_space_group_name_H-M   'P 6/m c c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   9.208
_cell_length_b                   9.208
_cell_length_c                   9.188
_cell_formula_units_Z            2
_cell_volume                     674.656
_database_code_amcsd             0001040
_diffrn_ambient_pressure         100
_exptl_crystal_density_diffrn    2.646
_cod_original_formula_sum        'Be3 Al2 Si6 O18'
_cod_database_code               9001018