LMucko/crystallography-open-database huggingface dataset:
The crystal structure of a simple rhombohedral form of boron Locality: synthetic
Decker, B. F.; Kasper, J. S.; Acta Crystallographica 12 (1959) 503–506; doi:10.1107/S0365110X59001529

data_9011036
_publ_section_title
;
 The crystal structure of a simple rhombohedral form of boron
 Locality: synthetic
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              503
_journal_page_last               506
_journal_paper_doi               10.1107/S0365110X59001529
_journal_volume                  12
_journal_year                    1959
_chemical_formula_sum            B
_chemical_name_common            Boron
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.908
_cell_length_b                   4.908
_cell_length_c                   12.567
_cell_formula_units_Z            36
_cell_volume                     262.163
_exptl_crystal_density_diffrn    2.465
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_database_code               9011036
_database_code_amcsd 0009230
Refinement of the structure of LiMnPO4
Geller, S.; Durand, J. L.; Acta Crystallographica 13 (1960) 325–331; doi:10.1107/S0365110X60002521

data_9011037
_publ_section_title
;
 Refinement of the structure of LiMnPO4
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              325
_journal_page_last               331
_journal_paper_doi               10.1107/S0365110X60002521
_journal_volume                  13
_journal_year                    1960
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Li Mn O4 P'
_chemical_name_mineral           Lithiophilite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2bc 2a'
_symmetry_space_group_name_H-M   'P m n b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   6.10
_cell_length_b                   10.46
_cell_length_c                   4.744
_cell_formula_units_Z            4
_cell_volume                     302.696
_database_code_amcsd             0009238
_exptl_crystal_density_diffrn    3.442
_cod_original_formula_sum        'Li Mn P O4'
_cod_database_code               9011037
Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
Strunz, V. H.; Contag, B.; Acta Crystallographica 13 (1960) 601–603; doi:10.1107/S0365110X60001436

data_9011038
_publ_section_title
;
 Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              601
_journal_page_last               603
_journal_paper_doi               10.1107/S0365110X60001436
_journal_volume                  13
_journal_year                    1960
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Fe H6 O6 Sn'
_chemical_name_mineral           Natanite
_space_group_IT_number           224
_symmetry_space_group_name_Hall  '-P 4bc 2bc 3'
_symmetry_space_group_name_H-M   'P n -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.79
_cell_length_b                   7.79
_cell_length_c                   7.79
_cell_volume                     472.729
_database_code_amcsd             0009240
_exptl_crystal_density_diffrn    3.886
_cod_original_sg_symbol_H-M      'P n 3 m'
_cod_original_formula_sum        'Fe Sn (O6 H6)'
_cod_database_code               9011038
Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
Strunz, V. H.; Contag, B.; Acta Crystallographica 13 (1960) 601–603; doi:10.1107/S0365110X60001436

data_9011039
_publ_section_title
;
 Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              601
_journal_page_last               603
_journal_paper_doi               10.1107/S0365110X60001436
_journal_volume                  13
_journal_year                    1960
_chemical_formula_structural     MnSn(OH)6
_chemical_formula_sum            'H6 Mn O6 Sn'
_space_group_IT_number           224
_symmetry_space_group_name_Hall  '-P 4bc 2bc 3'
_symmetry_space_group_name_H-M   'P n -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.88
_cell_length_b                   7.88
_cell_length_c                   7.88
_cell_volume                     489.304
_database_code_amcsd             0009241
_exptl_crystal_density_diffrn    3.742
_cod_original_sg_symbol_H-M      'P n 3 m'
_cod_original_formula_sum        'Mn Sn (O6 H6)'
_cod_database_code               9011039
_amcsd_formula_title             MnSn(OH)6
Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
Strunz, V. H.; Contag, B.; Acta Crystallographica 13 (1960) 601–603; doi:10.1107/S0365110X60001436

data_9011040
_publ_section_title
;
 Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              601
_journal_page_last               603
_journal_paper_doi               10.1107/S0365110X60001436
_journal_volume                  13
_journal_year                    1960
_chemical_formula_structural     CoSn(OH)6
_chemical_formula_sum            'Co H6 O6 Sn'
_space_group_IT_number           224
_symmetry_space_group_name_Hall  '-P 4bc 2bc 3'
_symmetry_space_group_name_H-M   'P n -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.78
_cell_length_b                   7.78
_cell_length_c                   7.78
_cell_volume                     470.911
_database_code_amcsd             0009242
_exptl_crystal_density_diffrn    3.945
_cod_original_sg_symbol_H-M      'P n 3 m'
_cod_original_formula_sum        'Co Sn (O6 H6)'
_cod_database_code               9011040
_amcsd_formula_title             CoSn(OH)6
Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
Strunz, V. H.; Contag, B.; Acta Crystallographica 13 (1960) 601–603; doi:10.1107/S0365110X60001436

data_9011041
_publ_section_title
;
 Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              601
_journal_page_last               603
_journal_paper_doi               10.1107/S0365110X60001436
_journal_volume                  13
_journal_year                    1960
_chemical_formula_structural     MgSn(OH)6
_chemical_formula_sum            'H6 Mg O6 Sn'
_space_group_IT_number           224
_symmetry_space_group_name_Hall  '-P 4bc 2bc 3'
_symmetry_space_group_name_H-M   'P n -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.77
_cell_length_b                   7.77
_cell_length_c                   7.77
_cell_volume                     469.097
_database_code_amcsd             0009243
_exptl_crystal_density_diffrn    3.470
_cod_original_sg_symbol_H-M      'P n 3 m'
_cod_original_formula_sum        'Mg Sn (O6 H6)'
_cod_database_code               9011041
_amcsd_formula_title             MgSn(OH)6
Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
Strunz, V. H.; Contag, B.; Acta Crystallographica 13 (1960) 601–603; doi:10.1107/S0365110X60001436

data_9011042
_publ_section_title
;
 Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              601
_journal_page_last               603
_journal_paper_doi               10.1107/S0365110X60001436
_journal_volume                  13
_journal_year                    1960
_chemical_formula_structural     CaSn(OH)6
_chemical_formula_sum            'Ca H6 O6 Sn'
_space_group_IT_number           224
_symmetry_space_group_name_Hall  '-P 4bc 2bc 3'
_symmetry_space_group_name_H-M   'P n -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.13
_cell_length_b                   8.13
_cell_length_c                   8.13
_cell_volume                     537.368
_database_code_amcsd             0009244
_exptl_crystal_density_diffrn    3.224
_cod_original_sg_symbol_H-M      'P n 3 m'
_cod_original_formula_sum        'Ca Sn (O6 H6)'
_cod_database_code               9011042
_amcsd_formula_title             CaSn(OH)6
The crystal structure of foshagite
Gard, J. A.; Taylor, H. F. W.; Acta Crystallographica 13 (1960) 785–793; doi:10.1107/S0365110X60001898

data_9011043
_publ_section_title
;
 The crystal structure of foshagite
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              785
_journal_page_last               793
_journal_paper_doi               10.1107/S0365110X60001898
_journal_volume                  13
_journal_year                    1960
_chemical_compound_source        'Crestmore, California, USA'
_chemical_formula_sum            'Ca4 H2 O11 Si3'
_chemical_name_mineral           Foshagite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                90
_cell_angle_beta                 106.4
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   10.32
_cell_length_b                   7.36
_cell_length_c                   7.04
_cell_volume                     512.969
_database_code_amcsd             0009245
_exptl_crystal_density_diffrn    2.736
_cod_original_sg_symbol_H-M      'P 1 -1 1'
_cod_original_formula_sum        'Ca4 Si3 O11 H2'
_cod_database_code               9011043
Die kristallstruktur von lithiumphosphat, Li3PO4
Zemann, J.; Acta Crystallographica 13 (1960) 863–867; doi:10.1107/S0365110X60002132

data_9011044
_publ_section_title
;
 Die kristallstruktur von lithiumphosphat, Li3PO4
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              863
_journal_page_last               867
_journal_paper_doi               10.1107/S0365110X60002132
_journal_volume                  13
_journal_year                    1960
_chemical_formula_sum            'Li3 O4 P'
_chemical_name_mineral           Lithiophosphate
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2bc 2a'
_symmetry_space_group_name_H-M   'P m n b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   6.12
_cell_length_b                   10.53
_cell_length_c                   4.93
_cell_formula_units_Z            4
_cell_volume                     317.707
_database_code_amcsd             0009246
_exptl_crystal_density_diffrn    2.421
_cod_original_formula_sum        'Li3 P O4'
_cod_database_code               9011044
X-ray diffraction study of indium phosphate dihydrate and isostructural thallic compounds
Mooney-Slater R C L; Acta Crystallographica 14 (1961) 1140–1146; doi:10.1107/S0365110X61003351

data_9011045
_publ_section_title
;X-ray diffraction study of indium phosphate dihydrate and isostructural
 thallic compounds
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              1140
_journal_page_last               1146
_journal_paper_doi               10.1107/S0365110X61003351
_journal_volume                  14
_journal_year                    1961
_chemical_formula_structural     InPO4*2H2O
_chemical_formula_sum            'H4 In O6 P'
_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                   10.36
_cell_length_b                   8.84
_cell_length_c                   10.19
_cell_volume                     933.225
_database_code_amcsd             0009264
_exptl_crystal_density_diffrn    3.499
_cod_original_formula_sum        'In P O6 H4'
_cod_database_code               9011045
_amcsd_formula_title             InPO4*2H2O
Contribution a l'etude structurale des sulfures d'arsenic et de plomb. Structure de la baumhauerite
Le Bihan, M. T.; Acta Crystallographica 14 (1961) 1210–1211; doi:10.1107/S0365110X61003533

data_9011046
_publ_section_title
;
 Contribution a l'etude structurale des sulfures d'arsenic et de plomb.
 Structure de la baumhauerite
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              1210
_journal_page_last               1211
_journal_paper_doi               10.1107/S0365110X61003533
_journal_volume                  14
_journal_year                    1961
_chemical_compound_source        'Binnenthal, Switzerland'
_chemical_formula_sum            'As9 Pb5 S18'
_chemical_name_mineral           Baumhauerite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                90
_cell_angle_beta                 97.40
_cell_angle_gamma                90
_cell_length_a                   22.78
_cell_length_b                   8.33
_cell_length_c                   7.90
_cell_formula_units_Z            2
_cell_volume                     1486.598
_database_code_amcsd             0009265
_exptl_crystal_density_diffrn    5.110
_cod_original_sg_symbol_H-M      'P 1 -1 1'
_cod_original_formula_sum        'Pb5 As9 S18'
_cod_database_code               9011046
Structure de la rathite II. Comparaison entre les differentes structures connues de sulfures d'arsenic et de plomb
Le Bihan, M. T.; Acta Crystallographica 14 (1961) 1211–1212; doi:10.1107/S0365110X61003545

data_9011047
_publ_section_title
;
 Structure de la rathite II. Comparaison entre les differentes structures
 connues de sulfures d'arsenic et de plomb
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              1211
_journal_page_last               1212
_journal_paper_doi               10.1107/S0365110X61003545
_journal_volume                  14
_journal_year                    1961
_chemical_formula_sum            'As13 Pb9 S28'
_chemical_name_mineral           Liveingite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.25
_cell_angle_gamma                90
_cell_length_a                   8.43
_cell_length_b                   70.90
_cell_length_c                   7.91
_cell_formula_units_Z            4
_cell_volume                     4727.659
_database_code_amcsd             0009266
_exptl_crystal_density_diffrn    5.250
_cod_original_formula_sum        'Pb9 As13 S28'
_cod_database_code               9011047
The crystal structure of sodium bicarbonate
Sass, R. L.; Scheuerman, R. F.; Acta Crystallographica 15 (1962) 77–81; doi:10.1107/S0365110X62000158

data_9011048
_publ_section_title
;
 The crystal structure of sodium bicarbonate
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              77
_journal_page_last               81
_journal_paper_doi               10.1107/S0365110X62000158
_journal_volume                  15
_journal_year                    1962
_chemical_compound_source        Synthetic
_chemical_formula_sum            'C H Na O3'
_chemical_name_mineral           Nahcolite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 111.85
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   3.51
_cell_length_b                   9.71
_cell_length_c                   8.05
_cell_volume                     254.651
_database_code_amcsd             0009267
_exptl_crystal_density_diffrn    2.191
_cod_original_formula_sum        'Na C O3 H'
_cod_database_code               9011048
The crystal structure of lithium diborate, Li2O*2B2O3
Krogh-Moe J; Acta Crystallographica 15 (1962) 190–193; doi:10.1107/S0365110X6200050X

data_9011049
_publ_section_title
;
 The crystal structure of lithium diborate, Li2O*2B2O3
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              190
_journal_page_last               193
_journal_paper_doi               10.1107/S0365110X6200050X
_journal_volume                  15
_journal_year                    1962
_chemical_compound_source        Synthetic
_chemical_formula_sum            'B4 Li2 O7'
_chemical_name_mineral           Diomignite
_space_group_IT_number           110
_symmetry_space_group_name_Hall  'I 4bw -2c'
_symmetry_space_group_name_H-M   'I 41 c d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.47
_cell_length_b                   9.47
_cell_length_c                   10.26
_cell_volume                     920.126
_database_code_amcsd             0009268
_exptl_crystal_density_diffrn    2.442
_cod_original_formula_sum        'Li2 B4 O7'
_cod_database_code               9011049
Precise lattice constants of germanium, aluminum, gallium arsenide, uranium, sulphur, quartz and sapphire Sample: at T = 24.6 C
Cooper, A. S.; Acta Crystallographica 15 (1962) 578–582; doi:10.1107/S0365110X62001474

data_9011050
_publ_section_title
;
 Precise lattice constants of germanium, aluminum, gallium arsenide, uranium,
 sulphur, quartz and sapphire
 Sample: at T = 24.6 C
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              578
_journal_page_last               582
_journal_paper_doi               10.1107/S0365110X62001474
_journal_volume                  15
_journal_year                    1962
_chemical_compound_source        Synthetic
_chemical_formula_sum            Ge
_chemical_name_mineral           Germanium
_space_group_IT_number           227
_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_length_a                   5.65754
_cell_length_b                   5.65754
_cell_length_c                   5.65754
_cell_formula_units_Z            8
_cell_volume                     181.085
_database_code_amcsd             0009269
_diffrn_ambient_temperature      297.75
_exptl_crystal_density_diffrn    5.327
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9011050
The crystal structure of Pd17Se15 Sample: Pm3m refinement
Geller, S.; Acta Crystallographica 15 (1962) 713–721; doi:10.1107/S0365110X62001929

data_9011051
_publ_section_title
;
 The crystal structure of Pd17Se15
 Sample: Pm3m refinement
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              713
_journal_page_last               721
_journal_paper_doi               10.1107/S0365110X62001929
_journal_volume                  15
_journal_year                    1962
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Pd17 Se15'
_chemical_name_mineral           Palladseite
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   10.606
_cell_length_b                   10.606
_cell_length_c                   10.606
_cell_formula_units_Z            2
_cell_volume                     1193.040
_database_code_amcsd             0009271
_exptl_crystal_density_diffrn    8.333
_cod_original_sg_symbol_H-M      'P m 3 m'
_cod_database_code               9011051
The crystal structure of Pd17Se15 Sample: P-43m refinement
Geller, S.; Acta Crystallographica 15 (1962) 713–721; doi:10.1107/S0365110X62001929

data_9011052
_publ_section_title
;
 The crystal structure of Pd17Se15
 Sample: P-43m refinement
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              713
_journal_page_last               721
_journal_paper_doi               10.1107/S0365110X62001929
_journal_volume                  15
_journal_year                    1962
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Pd17 Se15'
_chemical_name_mineral           Palladseite
_space_group_IT_number           215
_symmetry_space_group_name_Hall  'P -4 2 3'
_symmetry_space_group_name_H-M   'P -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   10.606
_cell_length_b                   10.606
_cell_length_c                   10.606
_cell_formula_units_Z            2
_cell_volume                     1193.040
_database_code_amcsd             0009272
_exptl_crystal_density_diffrn    8.333
_cod_database_code               9011052
The crystal structure of Pd17Se15 Sample: P432 refinement
Geller, S.; Acta Crystallographica 15 (1962) 713–721; doi:10.1107/S0365110X62001929

data_9011053
_publ_section_title
;
 The crystal structure of Pd17Se15
 Sample: P432 refinement
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              713
_journal_page_last               721
_journal_paper_doi               10.1107/S0365110X62001929
_journal_volume                  15
_journal_year                    1962
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Pd17 Se15'
_chemical_name_mineral           Palladseite
_space_group_IT_number           207
_symmetry_space_group_name_Hall  'P 4 2 3'
_symmetry_space_group_name_H-M   'P 4 3 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   10.606
_cell_length_b                   10.606
_cell_length_c                   10.606
_cell_formula_units_Z            2
_cell_volume                     1193.040
_database_code_amcsd             0009273
_exptl_crystal_density_diffrn    8.333
_cod_database_code               9011053
The crystal structure of cubic metaboric acid
Zachariasen, W. H.; Acta Crystallographica 16 (1963) 380–384; doi:10.1107/S0365110X63001018

data_9011054
_publ_section_title
;
 The crystal structure of cubic metaboric acid
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              380
_journal_page_last               384
_journal_paper_doi               10.1107/S0365110X63001018
_journal_volume                  16
_journal_year                    1963
_chemical_compound_source        Synthetic
_chemical_formula_sum            'B H O2'
_chemical_name_mineral           Metaborite
_space_group_IT_number           218
_symmetry_space_group_name_Hall  'P -4n 2 3'
_symmetry_space_group_name_H-M   'P -4 3 n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            24
_cell_length_a                   8.886
_cell_length_b                   8.886
_cell_length_c                   8.886
_cell_volume                     701.647
_database_code_amcsd             0009277
_exptl_crystal_density_diffrn    2.489
_cod_original_formula_sum        'B O2 H'
_cod_database_code               9011054