LMucko/crystallography-open-database huggingface dataset:
The Structure of Epididymite (H Na Be Si3 O8)
Ito, T; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 142–149; doi:

data_1011010
_publ_section_title
;
The Structure of Epididymite (H Na Be Si3 O8)
;
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              142
_journal_page_last               149
_journal_volume                  88
_journal_year                    1934
_chemical_compound_source        'from Greenland'
_chemical_formula_structural     'H Na Be Si3 O8'
_chemical_formula_sum            'Be H Na O8 Si3'
_chemical_name_mineral           Epididymite
_chemical_name_systematic        'Sodium beryllium hydrogen silicate *'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      62
_symmetry_space_group_name_Hall  '-P 2c 2n'
_symmetry_space_group_name_H-M   'P n a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.63
_cell_length_b                   7.32
_cell_length_c                   13.58
_cell_volume                     1255.5
_exptl_crystal_density_meas      2.55
_cod_original_formula_sum        'H Be Na O8 Si3'
_cod_database_code               1011010
The Crystal Structure of Enargite, Cu3 As S4
Pauling, L; Weinbaum, S; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 48–53; doi:

data_1011011
_publ_section_title
;
The Crystal Structure of Enargite, Cu3 As S4
;
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              48
_journal_page_last               53
_journal_volume                  88
_journal_year                    1934
_chemical_compound_source        'from the Phillipine Islands'
_chemical_formula_structural     'Cu3 As S4'
_chemical_formula_sum            'As Cu3 S4'
_chemical_name_mineral           Enargite
_chemical_name_systematic        'Tricopper(I) tetrathioarsenate'
_space_group_IT_number           31
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      31
_symmetry_space_group_name_Hall  'P 2bc -2bc'
_symmetry_space_group_name_H-M   'P n m 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.46(2)
_cell_length_b                   7.43(2)
_cell_length_c                   6.18(2)
_cell_volume                     296.6
_database_code_amcsd             0010518
_exptl_crystal_density_diffrn    4.409
_exptl_crystal_density_meas      4.43(8)
_cod_database_code               1011011
The Symmetry and Crystal Structure of Manganite, Mn (O H) O
Buerger, M J; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 95 (1936) 163–174; doi:

data_1011012
_publ_section_title
;
The Symmetry and Crystal Structure of Manganite, Mn (O H) O
;
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              163
_journal_page_last               174
_journal_volume                  95
_journal_year                    1936
_chemical_compound_source        'from Ilfeld, Harz Mts., Germany'
_chemical_formula_structural     'Mn (O H) O'
_chemical_formula_sum            'H Mn O2'
_chemical_name_mineral           Manganite
_chemical_name_systematic        'Manganese(III) hydroxide oxide'
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc (x+1/2*z,y,1/2*z)'
_space_group_name_H-M_alt        'B 1 21/d 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.(0)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.86
_cell_length_b                   5.24
_cell_length_c                   5.7
_cell_volume                     264.6
_exptl_crystal_density_meas      4.33
_cod_depositor_comments
;
 Updating space group information.

 2018-06-13,
 Antanas Vaitkus
;
_cod_database_code               1011012
Interatomic Distances in Marcasite and Notes on the Bonding in Crystals of Loellingite, Arsenopyrite, and Marcasite Types.
Buerger, M J; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 97 (1937) 504–513; doi:

data_1011013
_publ_section_title
;
Interatomic Distances in Marcasite and Notes on the Bonding in Crystals
of Loellingite, Arsenopyrite, and Marcasite Types.
;
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              504
_journal_page_last               513
_journal_volume                  97
_journal_year                    1937
_chemical_compound_source        'from Joplin district, Missouri'
_chemical_formula_structural     'Fe S2'
_chemical_formula_sum            'Fe S2'
_chemical_name_mineral           Marcasite
_chemical_name_systematic        'Iron(II) duo-disulfide'
_space_group_IT_number           58
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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            2
_cell_length_a                   4.436
_cell_length_b                   5.414
_cell_length_c                   3.381
_cell_volume                     81.2
_exptl_crystal_density_meas      4.89
_cod_database_code               1011013
The Crystal Structure of Cupric Chloride Dihydrate Cu Cl2 (H2 O)2
Harker, D; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 93 (1936) 136–145; doi:

data_1011014
_publ_section_title
;
The Crystal Structure of Cupric Chloride Dihydrate Cu Cl2 (H2 O)2
;
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              136
_journal_page_last               145
_journal_volume                  93
_journal_year                    1936
_chemical_compound_source        synthetic
_chemical_formula_structural     'Cu Cl2 (H2 O)2'
_chemical_formula_sum            'Cl2 Cu H4 O2'
_chemical_name_mineral           Eriochalcite
_chemical_name_systematic        'Copper chloride dihydrate'
_space_group_IT_number           53
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      53
_symmetry_space_group_name_Hall  '-P 2ab 2ab'
_symmetry_space_group_name_H-M   'P b m n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.38
_cell_length_b                   8.04
_cell_length_c                   3.72
_cell_volume                     220.7
_exptl_crystal_density_meas      2.45
_cod_original_formula_sum        'H4 Cl2 Cu O2'
_cod_database_code               1011014
The Crystal Structure of the Chlorite Minerals.
McMurchy, G C; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 420–432; doi:

data_1011015
_publ_section_title
;
The Crystal Structure of the Chlorite Minerals.
;
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              420
_journal_page_last               432
_journal_volume                  88
_journal_year                    1934
_chemical_compound_source        'from Philipsburg, Montana, USA'
_chemical_formula_structural     'Al2 Mg5 Si3 O10 (O H)8'
_chemical_formula_sum            'Al2 H8 Mg5 O18 Si3'
_chemical_name_mineral           'Clinochlore 2M'
_chemical_name_systematic
;
Dialuminium pentamagnesium trisilicate octahydroxide
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 97.147
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.305
_cell_length_b                   9.189
_cell_length_c                   28.5
_cell_volume                     1378.5
_exptl_crystal_density_meas      2.68
_cod_original_formula_sum        'H8 Al2 Mg5 O18 Si3'
_cod_database_code               1011015
The Crystal Lattice of Sodium Bicarbonate, Na H C O3
Zachariasen, W. H.; Journal of Chemical Physics 1 (1933) 634–639; doi:10.1063/1.1749342

data_1011016
_publ_section_title
;
The Crystal Lattice of Sodium Bicarbonate, Na H C O3
;
_journal_coden_ASTM              JCPSA6
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              634
_journal_page_last               639
_journal_paper_doi               10.1063/1.1749342
_journal_volume                  1
_journal_year                    1933
_chemical_compound_source        'synthetic by evaporation'
_chemical_formula_structural     'Na (H C O3)'
_chemical_formula_sum            'C H Na O3'
_chemical_name_mineral           Nahcolite
_chemical_name_systematic        'Sodium hydrogen carbonate'
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 93.32
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.51(4)
_cell_length_b                   9.70(4)
_cell_length_c                   3.53(3)
_cell_volume                     256.7
_exptl_crystal_density_meas      2.21(1)
_cod_original_formula_sum        'H Na O3'
_cod_database_code               1011016
Structure cristalline de la laurionite
Goldsztaub, S; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 204 (1937) 702–703; doi:

data_1011017
_publ_section_title              'Structure cristalline de la laurionite'
_journal_coden_ASTM              COREAF
_journal_name_full
;
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences
(1884 - 1965)
;
_journal_page_first              702
_journal_page_last               703
_journal_volume                  204
_journal_year                    1937
_chemical_formula_structural     'Pb (O H) Cl'
_chemical_formula_sum            'Cl H O Pb'
_chemical_name_mineral           Laurionite
_chemical_name_systematic        'Lead hydroxide chloride'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      62
_symmetry_space_group_name_Hall  '-P 2c 2n'
_symmetry_space_group_name_H-M   'P n a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.1
_cell_length_b                   9.7
_cell_length_c                   4.05
_cell_volume                     278.9
_exptl_crystal_density_meas      6.24
_cod_depositor_comments
;
 Removing dummy H atoms since the hydrogen atoms they represent are already
 marked using the _atom_site_attached_hydrogens data item.

 Antanas Vaitkus,
 2017-09-11
;
_cod_original_formula_sum        'H Cl O Pb'
_cod_database_code               1011017
Crystal Structure of Bronzite from Chichi-jiama in the Bonin Islands
Takané, Katsutashi; Proceedings of the Imperial Academy (Tokyo) 8 (1932) 308–311; doi:10.2183/pjab1912.8.308

data_1011018
_publ_section_title
;
 Crystal Structure of Bronzite from Chichi-jiama in the Bonin Islands
;
_journal_coden_ASTM              PIATA8
_journal_issue                   7
_journal_name_full               'Proceedings of the Imperial Academy (Tokyo)'
_journal_page_first              308
_journal_page_last               311
_journal_paper_doi               10.2183/pjab1912.8.308
_journal_volume                  8
_journal_year                    1932
_chemical_compound_source        'from Chichi-jima, Bonin Islands'
_chemical_formula_structural     'Fe.155 Mg.845 Si O3'
_chemical_formula_sum            'Fe0.155 Mg0.845 O3 Si'
_chemical_name_mineral           'Enstatite ferroan'
_chemical_name_systematic        'Magnesium iron silicate *'
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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            16
_cell_length_a                   18.15999
_cell_length_b                   8.84
_cell_length_c                   5.19
_cell_volume                     833.2
_exptl_crystal_density_meas      3.34
_cod_original_formula_sum        'Fe.155 Mg.845 O3 Si'
_cod_database_code               1011018
Ueber die Kristallstruktur von Glaserit und Kaliumsulfat.
Gossner, B; Neues Jahrbuch fuer Mineralogie, Geologie und Palaeontologie. Beilage (- 1925) 57 (1928) 89–116; doi:

data_1011019
_publ_section_title
;
Ueber die Kristallstruktur von Glaserit und Kaliumsulfat.
;
_journal_coden_ASTM              NJMBLA
_journal_name_full
;
Neues Jahrbuch fuer Mineralogie, Geologie und Palaeontologie. Beilage (-
1925)
;
_journal_page_first              89
_journal_page_last               116
_journal_volume                  57
_journal_year                    1928
_chemical_formula_structural     'Na K3 (S O4)2'
_chemical_formula_sum            'K3 Na O8 S2'
_chemical_name_mineral           Aphthitalite
_chemical_name_systematic        'Sodium tripotassium sulfate'
_space_group_IT_number           164
_symmetry_cell_setting           trigonal
_symmetry_Int_Tables_number      164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   5.65(2)
_cell_length_b                   5.65(2)
_cell_length_c                   7.29(9)
_cell_volume                     201.5
_exptl_crystal_density_meas      2.7
_cod_database_code               1011019
Structure cristalline de la manganite.
Garrido, J; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 200 (1935) 69–71; doi:

data_1011020
_publ_section_title              'Structure cristalline de la manganite.'
_journal_coden_ASTM              COREAF
_journal_name_full
;
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences
(1884 - 1965)
;
_journal_page_first              69
_journal_page_last               71
_journal_volume                  200
_journal_year                    1935
_chemical_compound_source        'from Ilfeld, Harz Mts., Germany'
_chemical_formula_structural     'Mn O (O H)'
_chemical_formula_sum            'H Mn O2'
_chemical_name_mineral           Manganite
_chemical_name_systematic        'Manganese(III) oxide hydroxide'
_space_group_IT_number           58
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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            2
_cell_length_a                   4.42
_cell_length_b                   5.23
_cell_length_c                   2.87
_cell_volume                     66.3
_exptl_crystal_density_meas      4.3
_cod_database_code               1011020
Les structures des cristaux de Northupite, de Northupite bromee et de Tychite.
Shiba, H; Watanabe, T; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 193 (1931) 1421–1423; doi:

data_1011021
_publ_section_title
;
Les structures des cristaux de Northupite, de Northupite bromee et de
Tychite.
;
_journal_coden_ASTM              COREAF
_journal_name_full
;
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences
(1884 - 1965)
;
_journal_page_first              1421
_journal_page_last               1423
_journal_volume                  193
_journal_year                    1931
_chemical_compound_source        synthetic
_chemical_formula_structural     'Mg2 Na6 (C O3)4 Cl2'
_chemical_formula_sum            'C4 Cl2 Mg2 Na6 O12'
_chemical_name_mineral           Northupite
_chemical_name_systematic
;
Dimagnesium hexasodium tetrakis(carbonate) chloride
;
_space_group_IT_number           227
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   14.05
_cell_length_b                   14.05
_cell_length_c                   14.05
_cell_volume                     2773.5
_exptl_crystal_density_meas      2.37
_cod_depositor_comments
;
 Correcting the summary chemical formula by changing it from 'Cl2 Mg2 Na6 O12'
 to 'C4 Cl2 Mg2 Na6 O12'.

 Antanas Vaitkus,
 2018-07-07
;
_cod_original_sg_symbol_H-M      'F d -3 m S'
_cod_database_code               1011021
Les structures des cristaux de Northupite, de Northupite bromee et de Tychite.
Shiba, H; Watanabe, T; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 193 (1931) 1421–1423; doi:

data_1011022
_publ_section_title
;
Les structures des cristaux de Northupite, de Northupite bromee et de
Tychite.
;
_journal_coden_ASTM              COREAF
_journal_name_full
;
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences
(1884 - 1965)
;
_journal_page_first              1421
_journal_page_last               1423
_journal_volume                  193
_journal_year                    1931
_chemical_compound_source        artificial
_chemical_formula_structural     'Mg2 Na6 (C O3)4 Br2'
_chemical_formula_sum            'C4 Br2 Mg2 Na6 O12'
_chemical_name_mineral           'Northupite (Br)'
_chemical_name_systematic
;
Dimagnesium hexasodium tetrakis(carbonate) bromide
;
_space_group_IT_number           227
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   14.17
_cell_length_b                   14.17
_cell_length_c                   14.17
_cell_volume                     2845.2
_exptl_crystal_density_meas      2.67
_cod_depositor_comments
;
 Correcting the summary chemical formula by changing it from 'Br2 Mg2 Na6 O12'
 to 'C4 Br2 Mg2 Na6 O12'.

 Antanas Vaitkus,
 2018-07-07
;
_cod_original_sg_symbol_H-M      'F d -3 m S'
_cod_database_code               1011022
A Theory of Water and Ionic Solution, with Particular Reference to Hydrogen and Hydroxyl Ions
Bernal, J D; Fowler, R H; Journal of Chemical Physics 1 (1933) 515–548; doi:10.1063/1.1749327

data_1011023
_publ_section_title
;
A Theory of Water and Ionic Solution, with Particular Reference to
Hydrogen and Hydroxyl Ions
;
_journal_coden_ASTM              JCPSA6
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              515
_journal_page_last               548
_journal_paper_doi               10.1063/1.1749327
_journal_volume                  1
_journal_year                    1933
_chemical_formula_structural     'H2 O'
_chemical_formula_sum            'H2 O'
_chemical_name_mineral           'Ice Ih'
_chemical_name_systematic        'Dihydrogen oxide'
_space_group_IT_number           185
_symmetry_cell_setting           hexagonal
_symmetry_Int_Tables_number      185
_symmetry_space_group_name_Hall  'P 6c -2'
_symmetry_space_group_name_H-M   'P 63 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            12
_cell_length_a                   7.82
_cell_length_b                   7.82
_cell_length_c                   7.36
_cell_volume                     389.8
_exptl_crystal_density_meas      0.92
_cod_database_code               1011023
The Structure of Ice III
McFarlan, R L; Journal of Chemical Physics 4 (1936) 253–259; doi:10.1063/1.1749832

data_1011024
_publ_section_title              'The Structure of Ice III'
_journal_coden_ASTM              JCPSA6
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              253
_journal_page_last               259
_journal_paper_doi               10.1063/1.1749832
_journal_volume                  4
_journal_year                    1936
_chemical_formula_structural     'H2 O'
_chemical_formula_sum            'H2 O'
_chemical_name_mineral           'Ice III'
_chemical_name_systematic        'Dihydrogen oxide - Ice III'
_space_group_IT_number           72
_space_group_name_Hall           '-I 2 2c (x,y,z-1/4)'
_space_group_name_H-M_alt        'I b a m (a,b,c+1/4)'
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      72
_symmetry_space_group_name_H-M   'I b a m (a,b,c+1/4)'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   10.2
_cell_length_b                   5.87
_cell_length_c                   7.17
_cell_volume                     429.3
_exptl_crystal_density_meas      1.11
_cod_original_sg_symbol_H-M      'I b a m S'
_cod_database_code               1011024
The Crystal Structure of Hexagonal Silver Iodide
Helmholz, L; Journal of Chemical Physics 3 (1935) 740–747; doi:10.1063/1.1749584

data_1011025
_publ_section_title
;
The Crystal Structure of Hexagonal Silver Iodide
;
_journal_coden_ASTM              JCPSA6
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              740
_journal_page_last               747
_journal_volume                  3
_journal_year                    1935
_chemical_formula_structural     'Ag I'
_chemical_formula_sum            'Ag I'
_chemical_name_mineral           Iodargyrite
_chemical_name_systematic        'Silver iodide'
_symmetry_cell_setting           hexagonal
_symmetry_Int_Tables_number      186
_symmetry_space_group_name_H-M   'P 63 m c S'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   4.59
_cell_length_b                   4.59
_cell_length_c                   7.52
_cell_volume                     137.2
_cod_database_code               1011025
_journal_paper_doi 10.1063/1.1749584