LMucko/crystallography-open-database huggingface dataset:
The crystal structure of paragonite-2M1
Lin, C. Y.; Bailey, S. W.; American Mineralogist 69 (1984) 122–127; doi:

data_9000905
_publ_section_title
;
 The crystal structure of paragonite-2M1
;
_journal_name_full               'American Mineralogist'
_journal_page_first              122
_journal_page_last               127
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Al3.06 H2 Na O12 Si2.94'
_chemical_name_mineral           Paragonite
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 94.35
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.128
_cell_length_b                   8.898
_cell_length_c                   19.287
_cell_volume                     877.510
_database_code_amcsd             0000924
_exptl_crystal_density_diffrn    2.892
_cod_original_formula_sum        'Al3.06 Si2.94 Na O12 H2'
_cod_database_code               9000905
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure 24 deg C
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000906
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 24 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.0884
_cell_length_b                   5.0884
_cell_length_c                   14.0855
_cell_formula_units_Z            6
_cell_volume                     315.839
_database_code_amcsd             0000925
_diffrn_ambient_temperature      297.15
_exptl_crystal_density_diffrn    4.786
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000906
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure 400 deg C
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000907
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 400 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.108
_cell_length_b                   5.108
_cell_length_c                   14.1287
_cell_formula_units_Z            6
_cell_volume                     319.253
_database_code_amcsd             0000926
_diffrn_ambient_temperature      673.15
_exptl_crystal_density_diffrn    4.735
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000907
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure 600 deg C
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000908
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 600 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.1182
_cell_length_b                   5.1182
_cell_length_c                   14.1566
_cell_formula_units_Z            6
_cell_volume                     321.162
_database_code_amcsd             0000927
_diffrn_ambient_temperature      873.15
_exptl_crystal_density_diffrn    4.707
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000908
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure 800 deg C
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000909
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 800 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.128
_cell_length_b                   5.128
_cell_length_c                   14.187
_cell_formula_units_Z            6
_cell_volume                     323.085
_database_code_amcsd             0000928
_diffrn_ambient_temperature      1073.15
_exptl_crystal_density_diffrn    4.679
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000909
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure 1050 deg C
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000910
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 1050 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.1412
_cell_length_b                   5.1412
_cell_length_c                   14.225
_cell_formula_units_Z            6
_cell_volume                     325.621
_database_code_amcsd             0000929
_diffrn_ambient_temperature      1323.15
_exptl_crystal_density_diffrn    4.642
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000910
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure room temperature after heating
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000911
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 room temperature after heating
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.0889
_cell_length_b                   5.0889
_cell_length_c                   14.0933
_cell_formula_units_Z            6
_cell_volume                     316.076
_database_code_amcsd             0000930
_exptl_crystal_density_diffrn    4.783
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000911
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure 1 atm
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000912
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 1 atm
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.0875
_cell_length_b                   5.0875
_cell_length_c                   14.0827
_cell_formula_units_Z            6
_cell_volume                     315.664
_database_code_amcsd             0000931
_diffrn_ambient_pressure         100
_exptl_crystal_density_diffrn    4.789
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000912
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure 25.4 kbar
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000913
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 25.4 kbar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.0691
_cell_length_b                   5.0691
_cell_length_c                   13.9849
_cell_formula_units_Z            6
_cell_volume                     311.209
_database_code_amcsd             0000932
_diffrn_ambient_pressure         2.54e+06
_exptl_crystal_density_diffrn    4.857
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000913
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure 34.6 kbar
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000914
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 34.6 kbar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.0635
_cell_length_b                   5.0635
_cell_length_c                   13.9518
_cell_formula_units_Z            6
_cell_volume                     309.787
_database_code_amcsd             0000933
_diffrn_ambient_pressure         3.46e+06
_exptl_crystal_density_diffrn    4.880
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000914
Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure 46.1 kbar
Wechsler, B. A.; Prewitt, C. T.; American Mineralogist 69 (1984) 176–185; doi:

data_9000915
_publ_section_title
;
 Crystal structure of ilmenite (FeTiO3) at high temperature and high pressure
 46.1 kbar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              176
_journal_page_last               185
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_mineral           Ilmenite
_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                   5.0561
_cell_length_b                   5.0561
_cell_length_c                   13.9115
_cell_formula_units_Z            6
_cell_volume                     307.989
_database_code_amcsd             0000934
_diffrn_ambient_pressure         4.61e+06
_exptl_crystal_density_diffrn    4.908
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Ti O3'
_cod_database_code               9000915
Crystal structure of cappelenite, Ba(Y,RE)6[Si3B6O24]F2: a silicoborate sheet structure
Shen, J.; Moore, P. B.; American Mineralogist 69 (1984) 190–195; doi:

data_9000916
_publ_section_title
;
 Crystal structure of cappelenite, Ba(Y,RE)6[Si3B6O24]F2: a silicoborate
 sheet structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              190
_journal_page_last               195
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'B6 Ba F2 O24 Si3 Y6'
_chemical_name_mineral           Cappelenite-(Y)
_space_group_IT_number           143
_symmetry_space_group_name_Hall  'P 3'
_symmetry_space_group_name_H-M   'P 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   10.67
_cell_length_b                   10.67
_cell_length_c                   4.680
_cell_formula_units_Z            1
_cell_volume                     461.429
_database_code_amcsd             0000935
_exptl_crystal_density_diffrn    4.469
_cod_original_formula_sum        'Ba Y6 Si3 B6 O24 F2'
_cod_database_code               9000916
The crystal structure of high clinoferrosilicate T = 1050 C
Sueno, S.; Kimata, M.; Prewitt, C. T.; American Mineralogist 69 (1984) 264–269; doi:

data_9000917
_publ_section_title
;
 The crystal structure of high clinoferrosilicate
 T = 1050 C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              264
_journal_page_last               269
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Fe O3 Si'
_chemical_name_mineral           Clinoferrosilite
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 110.20
_cell_angle_gamma                90
_cell_length_a                   9.928
_cell_length_b                   9.179
_cell_length_c                   5.338
_cell_formula_units_Z            8
_cell_volume                     456.527
_database_code_amcsd             0000936
_diffrn_ambient_temperature      1323.15
_exptl_crystal_density_diffrn    3.839
_cod_original_formula_sum        'Fe Si O3'
_cod_database_code               9000917
Donpeacorite, (Mn,Mg)MgSi2O6, a new orthopyroxene and its proposed phase relations in the system MnSiO3-MgSiO3-FeSiO3
Petersen, E. U.; Anovitz, L. M.; Essene, E. J.; American Mineralogist 69 (1984) 472–480; doi:

data_9000918
_publ_section_title
;
 Donpeacorite, (Mn,Mg)MgSi2O6, a new orthopyroxene and its proposed phase
 relations in the system MnSiO3-MgSiO3-FeSiO3
;
_journal_name_full               'American Mineralogist'
_journal_page_first              472
_journal_page_last               480
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Mg1.47 Mn0.53 O6 Si2'
_chemical_name_mineral           Donpeacorite
_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_formula_units_Z            8
_cell_length_a                   18.384
_cell_length_b                   8.878
_cell_length_c                   5.226
_cell_volume                     852.952
_database_code_amcsd             0000937
_exptl_crystal_density_diffrn    3.380
_cod_original_formula_sum        'Mg1.47 Mn.53 Si2 O6'
_cod_database_code               9000918
Compressibility and crystal structure of andalusite at high pressure 12 kbar continuous-scan
Ralph, R. L.; Finger, L. W.; Hazen, R. M.; Ghose, S.; American Mineralogist 69 (1984) 513–519; doi:

data_9000919
_publ_section_title
;
 Compressibility and crystal structure of andalusite at high pressure
 12 kbar continuous-scan
;
_journal_name_full               'American Mineralogist'
_journal_page_first              513
_journal_page_last               519
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Al2 O5 Si'
_chemical_name_mineral           Andalusite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.7599
_cell_length_b                   7.8735
_cell_length_c                   5.544
_cell_volume                     338.725
_database_code_amcsd             0000938
_exptl_crystal_density_diffrn    3.178
_cod_original_formula_sum        'Al2 Si O5'
_cod_database_code               9000919
Compressibility and crystal structure of andalusite at high pressure 12 kbar step-scan
Ralph, R. L.; Finger, L. W.; Hazen, R. M.; Ghose, S.; American Mineralogist 69 (1984) 513–519; doi:

data_9000920
_publ_section_title
;
 Compressibility and crystal structure of andalusite at high pressure
 12 kbar step-scan
;
_journal_name_full               'American Mineralogist'
_journal_page_first              513
_journal_page_last               519
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Al2 O5 Si'
_chemical_name_mineral           Andalusite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.760
_cell_length_b                   7.873
_cell_length_c                   5.544
_cell_volume                     338.708
_database_code_amcsd             0000939
_exptl_crystal_density_diffrn    3.178
_cod_original_formula_sum        'Al2 Si O5'
_cod_database_code               9000920
Compressibility and crystal structure of andalusite at high pressure 25 kbar step-scan
Ralph, R. L.; Finger, L. W.; Hazen, R. M.; Ghose, S.; American Mineralogist 69 (1984) 513–519; doi:

data_9000921
_publ_section_title
;
 Compressibility and crystal structure of andalusite at high pressure
 25 kbar step-scan
;
_journal_name_full               'American Mineralogist'
_journal_page_first              513
_journal_page_last               519
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Al2 O5 Si'
_chemical_name_mineral           Andalusite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.7382
_cell_length_b                   7.8571
_cell_length_c                   5.5338
_cell_volume                     336.454
_database_code_amcsd             0000940
_exptl_crystal_density_diffrn    3.199
_cod_original_formula_sum        'Al2 Si O5'
_cod_database_code               9000921
Compressibility and crystal structure of andalusite at high pressure 37 kbar continuous scan
Ralph, R. L.; Finger, L. W.; Hazen, R. M.; Ghose, S.; American Mineralogist 69 (1984) 513–519; doi:

data_9000922
_publ_section_title
;
 Compressibility and crystal structure of andalusite at high pressure
 37 kbar continuous scan
;
_journal_name_full               'American Mineralogist'
_journal_page_first              513
_journal_page_last               519
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Al2 O5 Si'
_chemical_name_mineral           Andalusite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.7049
_cell_length_b                   7.8375
_cell_length_c                   5.5262
_cell_volume                     333.711
_database_code_amcsd             0000941
_exptl_crystal_density_diffrn    3.225
_cod_original_formula_sum        'Al2 Si O5'
_cod_database_code               9000922
The crystal structure of an Al-rich titanite from Grisons, Switzerland
Hollabaugh, C. L.; Foit, F. F.; American Mineralogist 69 (1984) 725–732; doi:

data_9000923
_publ_section_title
;
 The crystal structure of an Al-rich titanite from Grisons, Switzerland
;
_journal_name_full               'American Mineralogist'
_journal_page_first              725
_journal_page_last               732
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-A 2ya'
_symmetry_space_group_name_H-M   'A 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.9
_cell_angle_gamma                90
_cell_length_a                   7.050
_cell_length_b                   8.681
_cell_length_c                   6.539
_cell_formula_units_Z            4
_cell_volume                     365.879
_database_code_amcsd             0000942
_exptl_crystal_density_diffrn    3.559
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9000923
The crystal structure of an Al-rich titanite from Grisons, Switzerland
Hollabaugh, C. L.; Foit, F. F.; American Mineralogist 69 (1984) 725–732; doi:

data_9000924
_publ_section_title
;
 The crystal structure of an Al-rich titanite from Grisons, Switzerland
;
_journal_name_full               'American Mineralogist'
_journal_page_first              725
_journal_page_last               732
_journal_volume                  69
_journal_year                    1984
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_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                 113.9
_cell_angle_gamma                90
_cell_length_a                   7.050
_cell_length_b                   8.681
_cell_length_c                   6.539
_cell_formula_units_Z            4
_cell_volume                     365.879
_database_code_amcsd             0000943
_exptl_crystal_density_diffrn    3.559
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9000924