LMucko/crystallography-open-database huggingface dataset:
An X-Ray Study of the Caesium Salts of Certain 12-Heteropoly Acids
Santos, J A; Proceedings of the Royal Society of London, Series A: Mathematical and Physical Sciences (76,1906-) 150 (1935) 309–322; doi:10.1098/rspa.1935.0103

data_1010552
_publ_section_title
;
An X-Ray Study of the Caesium Salts of Certain 12-Heteropoly Acids
;
_journal_coden_ASTM              PRLAAZ
_journal_name_full
;
Proceedings of the Royal Society of London, Series A: Mathematical and
Physical Sciences (76,1906-)
;
_journal_page_first              309
_journal_page_last               322
_journal_paper_doi               10.1098/rspa.1935.0103
_journal_volume                  150
_journal_year                    1935
_chemical_formula_structural     'Cs3 H3 (H2 O4) (W O3)12 (H2 O)'
_chemical_formula_sum            'Cs3 H7 O41 W12'
_chemical_name_systematic        'Caesium tungstate hydrate *'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            0
_cell_length_a                   11.79(1)
_cell_length_b                   11.79(1)
_cell_length_c                   11.79(1)
_cell_volume                     1638.9
_cod_original_formula_sum        'H7 Cs3 O41 W12'
_cod_database_code               1010552
The Constitution and Formation of Bleaching Powder
Bunn, C W; Clark, L M; Clifford, I L; Proceedings of the Royal Society of London, Series A: Mathematical and Physical Sciences (76,1906-) 151 (1935) 141–167; doi:10.1098/rspa.1935.0138

data_1010553
_publ_section_title
;
The Constitution and Formation of Bleaching Powder
;
_journal_coden_ASTM              PRLAAZ
_journal_name_full
;
Proceedings of the Royal Society of London, Series A: Mathematical and
Physical Sciences (76,1906-)
;
_journal_page_first              141
_journal_page_last               167
_journal_paper_doi               10.1098/rspa.1935.0138
_journal_volume                  151
_journal_year                    1935
_chemical_formula_structural     'Ca (O Cl)2 (Ca (O H)2)2'
_chemical_formula_sum            'Ca3 Cl2 H4 O6'
_chemical_name_systematic        'Calcium bis(chlorate(I)) tetrahydroxide'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   6.305
_cell_length_b                   6.305
_cell_length_c                   6.535
_cell_volume                     225.0
_exptl_crystal_density_meas      2.1
_cod_original_formula_sum        'H4 Ca3 Cl2 O6'
_cod_database_code               1010553
The Constitution and Formation of Bleaching Powder
Bunn, C W; Clark, L M; Clifford, I L; Proceedings of the Royal Society of London, Series A: Mathematical and Physical Sciences (76,1906-) 151 (1935) 141–167; doi:10.1098/rspa.1935.0138

data_1010554
_publ_section_title
;
The Constitution and Formation of Bleaching Powder
;
_journal_coden_ASTM              PRLAAZ
_journal_name_full
;
Proceedings of the Royal Society of London, Series A: Mathematical and
Physical Sciences (76,1906-)
;
_journal_page_first              141
_journal_page_last               167
_journal_paper_doi               10.1098/rspa.1935.0138
_journal_volume                  151
_journal_year                    1935
_chemical_formula_structural     'Ca (O Cl)2 (H2 O)3'
_chemical_formula_sum            'Ca Cl2 H6 O5'
_chemical_name_systematic        'Calcium bis(chlorate(I)) trihydrate'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.04
_cell_length_b                   12.04
_cell_length_c                   8.65
_cell_volume                     1253.9
_exptl_crystal_density_meas      2.1
_cod_original_formula_sum        'H6 Ca Cl2 O5'
_cod_database_code               1010554
Ueber die Konstitution der festen basischen Salze zweiwertiger Metalle
Feitknecht, W; Helvetica Chimica Acta 20 (1937) 177–188; doi:10.1002/hlca.19370200123

data_1010555
_publ_section_title
;
Ueber die Konstitution der festen basischen Salze zweiwertiger Metalle
;
_journal_coden_ASTM              HCACAV
_journal_name_full               'Helvetica Chimica Acta'
_journal_page_first              177
_journal_page_last               188
_journal_paper_doi               10.1002/hlca.19370200123
_journal_volume                  20
_journal_year                    1937
_chemical_formula_structural     'Co (O H)1.5 (N O3)0.5'
_chemical_formula_sum            'Co H1.5 N0.5 O3'
_chemical_name_systematic        'Cobalt hydroxide nitrate *'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.173(5)
_cell_length_b                   3.173(5)
_cell_length_c                   6.96(5)
_cell_volume                     70.1
_exptl_crystal_density_meas      3.08
_cod_original_formula_sum        'H1.5 Co N.5 O3'
_cod_database_code               1010555
Über die α-Form der Hydroxide zweiwertiger Metalle
Feitknecht, W.; Helvetica Chimica Acta 21 (1938) 766–784; doi:10.1002/hlca.19380210199

data_1010556
_publ_section_title
;
 \"Uber die \a-Form der Hydroxide zweiwertiger Metalle
;
_journal_coden_ASTM              HCACAV
_journal_issue                   1
_journal_name_full               'Helvetica Chimica Acta'
_journal_page_first              766
_journal_page_last               784
_journal_paper_doi               10.1002/hlca.19380210199
_journal_volume                  21
_journal_year                    1938
_chemical_formula_structural     'Co0.5 Zn0.5 (O H)2'
_chemical_formula_sum            'Co0.5 H2 O2 Zn0.5'
_chemical_name_systematic        'Cobalt zinc hydroxide *'
_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            3
_cell_length_a                   3.176
_cell_length_b                   3.176
_cell_length_c                   4.64
_cell_volume                     40.5
_cod_original_formula_sum        'H2 Co.5 O2 Zn.5'
_cod_database_code               1010556
Die Kristallstruktur von Ammonium-, Kalium-, Rubidium- und Caesiumstannibromid
Ketelaar, A A; Rietdijk, A A; van Staveren, C H; Recueil des Travaux Chimiques des Pays-Bas et de la Belgique 56 (1937) 907–908; doi:

data_1010557
_publ_section_title
;
Die Kristallstruktur von Ammonium-, Kalium-, Rubidium- und
Caesiumstannibromid
;
_journal_coden_ASTM              RTCPA3
_journal_name_full
;
Recueil des Travaux Chimiques des Pays-Bas et de la Belgique
;
_journal_page_first              907
_journal_page_last               908
_journal_volume                  56
_journal_year                    1937
_chemical_formula_structural     '(N H4)2 Sn Br6'
_chemical_formula_sum            'Br6 H8 N2 Sn'
_chemical_name_systematic        'Ammonium hexabromostannate'
_space_group_IT_number           225
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.57(1)
_cell_length_b                   10.57(1)
_cell_length_c                   10.57(1)
_cell_volume                     1180.9
_exptl_crystal_density_meas      3.55
_cod_original_formula_sum        'H8 Br6 N2 Sn'
_cod_database_code               1010557
Die Kristallstruktur von Ammonium-, Kalium-, Rubidium- und Caesiumstannibromid
Ketelaar, A A; Rietdijk, A A; van Staveren, C H; Recueil des Travaux Chimiques des Pays-Bas et de la Belgique 56 (1937) 907–908; doi:

data_1010558
_publ_section_title
;
Die Kristallstruktur von Ammonium-, Kalium-, Rubidium- und
Caesiumstannibromid
;
_journal_coden_ASTM              RTCPA3
_journal_name_full
;
Recueil des Travaux Chimiques des Pays-Bas et de la Belgique
;
_journal_page_first              907
_journal_page_last               908
_journal_volume                  56
_journal_year                    1937
_chemical_formula_structural     'Rb2 Sn Br6'
_chemical_formula_sum            'Br6 Rb2 Sn'
_chemical_name_systematic        'Rubidium hexabromostannate'
_space_group_IT_number           225
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.58(1)
_cell_length_b                   10.58(1)
_cell_length_c                   10.58(1)
_cell_volume                     1184.3
_exptl_crystal_density_meas      4.29
_cod_database_code               1010558
Die Kristallstruktur von Ammonium-, Kalium-, Rubidium- und Caesiumstannibromid
Ketelaar, A A; Rietdijk, A A; van Staveren, C H; Recueil des Travaux Chimiques des Pays-Bas et de la Belgique 56 (1937) 907–908; doi:

data_1010559
_publ_section_title
;
Die Kristallstruktur von Ammonium-, Kalium-, Rubidium- und
Caesiumstannibromid
;
_journal_coden_ASTM              RTCPA3
_journal_name_full
;
Recueil des Travaux Chimiques des Pays-Bas et de la Belgique
;
_journal_page_first              907
_journal_page_last               908
_journal_volume                  56
_journal_year                    1937
_chemical_formula_structural     'Cs2 Sn Br6'
_chemical_formula_sum            'Br6 Cs2 Sn'
_chemical_name_systematic        'Caesium hexabromostannate'
_space_group_IT_number           225
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.77(1)
_cell_length_b                   10.77(1)
_cell_length_c                   10.77(1)
_cell_volume                     1249.2
_exptl_crystal_density_meas      4.56
_cod_database_code               1010559
Konstitution der Erdalkalihydride
Zintl, E.; Harder, A.; Zeitschrift für Elektrochemie und angewandte physikalische Chemie 41 (1935) 33–52; doi:10.1002/bbpc.19350410110

data_1010560
_publ_section_title              'Konstitution der Erdalkalihydride'
_journal_coden_ASTM              ZEELAI
_journal_issue                   1
_journal_name_full
;
 Zeitschrift f\"ur Elektrochemie und angewandte physikalische Chemie
;
_journal_page_first              33
_journal_page_last               52
_journal_paper_doi               10.1002/bbpc.19350410110
_journal_volume                  41
_journal_year                    1935
_chemical_formula_structural     'Sr H2'
_chemical_formula_sum            'H2 Sr'
_chemical_name_systematic        'Strontium hydride'
_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                   6.364
_cell_length_b                   7.343
_cell_length_c                   3.875
_cell_volume                     181.1
_exptl_crystal_density_meas      3.26
_cod_database_code               1010560
Konstitution der Erdalkalihydride
Zintl, E.; Harder, A.; Zeitschrift für Elektrochemie und angewandte physikalische Chemie 41 (1935) 33–52; doi:10.1002/bbpc.19350410110

data_1010561
_publ_section_title              'Konstitution der Erdalkalihydride'
_journal_coden_ASTM              ZEELAI
_journal_issue                   1
_journal_name_full
;
 Zeitschrift f\"ur Elektrochemie und angewandte physikalische Chemie
;
_journal_page_first              33
_journal_page_last               52
_journal_paper_doi               10.1002/bbpc.19350410110
_journal_volume                  41
_journal_year                    1935
_chemical_formula_structural     'Ca H2'
_chemical_formula_sum            'Ca H2'
_chemical_name_systematic        'Calcium hydride'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.936
_cell_length_b                   6.838
_cell_length_c                   3.6
_cell_volume                     146.1
_exptl_crystal_density_meas      1.7
_cod_original_formula_sum        'H2 Ca'
_cod_database_code               1010561
Konstitution der Erdalkalihydride
Zintl, E.; Harder, A.; Zeitschrift für Elektrochemie und angewandte physikalische Chemie 41 (1935) 33–52; doi:10.1002/bbpc.19350410110

data_1010562
_publ_section_title              'Konstitution der Erdalkalihydride'
_journal_coden_ASTM              ZEELAI
_journal_issue                   1
_journal_name_full
;
 Zeitschrift f\"ur Elektrochemie und angewandte physikalische Chemie
;
_journal_page_first              33
_journal_page_last               52
_journal_paper_doi               10.1002/bbpc.19350410110
_journal_volume                  41
_journal_year                    1935
_chemical_formula_structural     'Ba H2'
_chemical_formula_sum            'Ba H2'
_chemical_name_systematic        'Barium hydride'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.788
_cell_length_b                   7.829
_cell_length_c                   4.167
_cell_volume                     221.4
_exptl_crystal_density_meas      4.21
_cod_original_formula_sum        'H2 Ba'
_cod_database_code               1010562
Zur Struktur Al Cl~3~
Laschkarew, W E; Zeitschrift fuer Anorganische und Allgemeine Chemie 193 (1930) 270–276; doi:10.1002/zaac.19301930123

data_1010563
_publ_section_title              'Zur Struktur Al Cl~3~'
_journal_coden_ASTM              ZAACAB
_journal_name_full
;
Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_page_first              270
_journal_page_last               276
_journal_paper_doi               10.1002/zaac.19301930123
_journal_volume                  193
_journal_year                    1930
_chemical_formula_structural     'Al Cl3'
_chemical_formula_sum            'Al Cl3'
_chemical_name_systematic        'Aluminium chloride'
_space_group_IT_number           1
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   3.475(1)
_cell_length_b                   3.475(1)
_cell_length_c                   8.51
_cell_volume                     89.0
_diffrn_radiation_wavelength     0.710
_exptl_crystal_density_meas      2.4
_cod_database_code               1010563
_cod_depositor_comments
;
  Adding coordinates from the original publication. As coordinates for
  all the atoms are given in the paper, 'P 1' symmetry is assumed.

  Andrius Merkys
  2017-10-18
;
Zur Kristallchemie der Heteropolysaeuren: Gibt es eine "isomere Borwolframsaeure"?
Kraus, O; Naturwissenschaften 28 (1940) 238–239; doi:10.1007/BF01491436

data_1010564
_publ_section_title
;
Zur Kristallchemie der Heteropolysaeuren: Gibt es eine "isomere
Borwolframsaeure"?
;
_journal_coden_ASTM              NATWAY
_journal_name_full               Naturwissenschaften
_journal_page_first              238
_journal_page_last               239
_journal_paper_doi               10.1007/BF01491436
_journal_volume                  28
_journal_year                    1940
_chemical_formula_analytical     '(B2 O3) (W O3)28 (H2 O)62'
_chemical_formula_structural     'B2 W28 O87 (H2 O)62'
_chemical_formula_sum            'B2 H124 O149 W28'
_chemical_name_systematic        'Boron tungsten oxide hydrate *'
_space_group_IT_number           176
_symmetry_cell_setting           hexagonal
_symmetry_Int_Tables_number      176
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            14
_cell_length_a                   21.66
_cell_length_b                   21.66
_cell_length_c                   21.54
_cell_volume                     8751.7
_cod_original_formula_sum        'H124 B2 O149 W28'
_cod_database_code               1010564
The structure of Risorite
Barth, T; Norsk Geologisk Tidsskrift 9 (1926) 37–39; doi:

data_1010565
_publ_section_title              'The structure of Risorite'
_journal_coden_ASTM              NOGTAO
_journal_name_full               'Norsk Geologisk Tidsskrift'
_journal_page_first              37
_journal_page_last               39
_journal_volume                  9
_journal_year                    1926
_chemical_formula_structural     'Fe Nb O4'
_chemical_formula_sum            'Fe Nb O4'
_chemical_name_mineral           'Fergusonite titanian'
_chemical_name_systematic        'Iron(III) niobium oxide'
_space_group_IT_number           83
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      83
_symmetry_space_group_name_Hall  '-P 4'
_symmetry_space_group_name_H-M   'P 4/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.78
_cell_length_b                   7.78
_cell_length_c                   11.41
_cell_volume                     690.6
_exptl_crystal_density_meas      5.17
_cod_database_code               1010565
X-Ray Studies on Potassium Antimonates
Spiegelberg, P; Arkiv foer Kemi, Mineralogi och Geologi, A 14 (1940) 1–12; doi:

data_1010566
_publ_section_title              'X-Ray Studies on Potassium Antimonates'
_journal_coden_ASTM              ARKGAJ
_journal_name_full               'Arkiv foer Kemi, Mineralogi och Geologi, A'
_journal_page_first              1
_journal_page_last               12
_journal_volume                  14
_journal_year                    1940
_chemical_formula_structural     'K Sb O3'
_chemical_formula_sum            'K O3 Sb'
_chemical_name_systematic        'Potassium catena-antimonate'
_space_group_IT_number           148
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  '-P 3*'
_symmetry_space_group_name_H-M   'R -3 :R'
_cell_angle_alpha                46.33
_cell_angle_beta                 46.33
_cell_angle_gamma                46.33
_cell_formula_units_Z            2
_cell_length_a                   6.814
_cell_length_b                   6.814
_cell_length_c                   6.814
_cell_volume                     151.1
_cod_original_sg_symbol_H-M      'R -3 R'
_cod_database_code               1010566
Die Krystallstruktur von NH~4~CdCl~3~ und RbCdCl~3~
MacGillavry, C H; Nijveld, H; Dierdorp, S; Karsten, J; Recueil des Travaux Chimiques des Pays-Bas et de la Belgique 58 (1939) 193–200; doi:

data_1010567
_publ_section_title
;
Die Krystallstruktur von NH~4~CdCl~3~ und RbCdCl~3~
;
_journal_coden_ASTM              RTCPA3
_journal_name_full
;
Recueil des Travaux Chimiques des Pays-Bas et de la Belgique
;
_journal_page_first              193
_journal_page_last               200
_journal_volume                  58
_journal_year                    1939
_chemical_formula_structural     'Rb Cd Cl3'
_chemical_formula_sum            'Cd Cl3 Rb'
_chemical_name_systematic        'Rubidium trichlorocadmate'
_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                   9.01
_cell_length_b                   14.93
_cell_length_c                   4.01
_cell_volume                     539.4
_cod_database_code               1010567
Roentgenographische Strukturerforschung der kubischen Modifikation der Perchlorate.
Herrmann, K; Ilge, W; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 75 (1930) 41–66; doi:

data_1010568
_publ_section_title
;
Roentgenographische Strukturerforschung der kubischen Modifikation der
Perchlorate.
;
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              41
_journal_page_last               66
_journal_volume                  75
_journal_year                    1930
_chemical_formula_structural     'K Cl O4'
_chemical_formula_sum            'Cl K O4'
_chemical_name_systematic        'Potassium chlorate(VII)'
_space_group_IT_number           216
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.47
_cell_length_b                   7.47
_cell_length_c                   7.47
_cell_volume                     416.8
_cod_database_code               1010568
Roentgenographische Strukturerforschung der kubischen Modifikation der Perchlorate.
Herrmann, K; Ilge, W; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 75 (1930) 41–66; doi:

data_1010569
_publ_section_title
;
Roentgenographische Strukturerforschung der kubischen Modifikation der
Perchlorate.
;
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              41
_journal_page_last               66
_journal_volume                  75
_journal_year                    1930
_chemical_formula_structural     'N H4 Cl O4'
_chemical_formula_sum            'Cl H4 N O4'
_chemical_name_systematic        'Ammonium chlorate(VII)'
_space_group_IT_number           216
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.63
_cell_length_b                   7.63
_cell_length_c                   7.63
_cell_volume                     444.2
_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        'H4 Cl N O4'
_cod_database_code               1010569