LMucko/crystallography-open-database huggingface dataset:
The crystal chemistry of the silicate garnets sample Uv
Novak, G. A.; Gibbs, G. V.; American Mineralogist 56 (1971) 791–823; doi:

data_9000237
_publ_section_title
;
 The crystal chemistry of the silicate garnets
 sample Uv
;
_journal_name_full               'American Mineralogist'
_journal_page_first              791
_journal_page_last               823
_journal_volume                  56
_journal_year                    1971
_chemical_compound_source        'Washington, Nevada Co, California, USA'
_chemical_formula_sum
'Al0.21 Ca2.991 Cr1.73 Fe0.05 Mn0.009 O12 Si3 Ti0.01'
_chemical_name_mineral           Uvarovite
_space_group_IT_number           230
_symmetry_space_group_name_Hall  '-I 4bd 2c 3'
_symmetry_space_group_name_H-M   'I a -3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   11.988
_cell_length_b                   11.988
_cell_length_c                   11.988
_cell_formula_units_Z            8
_cell_volume                     1722.821
_database_code_amcsd             0000244
_exptl_crystal_density_diffrn    3.821
_cod_original_formula_sum
'Si3 (Cr1.73 Al.21 Fe.05 Ti.01) (Ca2.991 Mn.009) O12'
_cod_database_code               9000237
The crystal chemistry of the silicate garnets sample Go
Novak, G. A.; Gibbs, G. V.; American Mineralogist 56 (1971) 791–823; doi:

data_9000238
_publ_section_title
;
 The crystal chemistry of the silicate garnets
 sample Go
;
_journal_name_full               'American Mineralogist'
_journal_page_first              791
_journal_page_last               823
_journal_volume                  56
_journal_year                    1971
_chemical_compound_source
'Laguna Uranium mining district, New Mexico, USA'
_chemical_formula_sum            'Al0.48 Ca2.91 Fe0.32 Mg0.09 O12 Si3 V1.2'
_chemical_name_mineral           Goldmanite
_space_group_IT_number           230
_symmetry_space_group_name_Hall  '-I 4bd 2c 3'
_symmetry_space_group_name_H-M   'I a -3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   12.011
_cell_length_b                   12.011
_cell_length_c                   12.011
_cell_formula_units_Z            8
_cell_volume                     1732.756
_database_code_amcsd             0000245
_exptl_crystal_density_diffrn    3.734
_cod_original_formula_sum        'Si3 (V1.2 Al.48 Fe.32) (Ca2.91 Mg.09) O12'
_cod_database_code               9000238
The crystal chemistry of the silicate garnets sample An
Novak, G. A.; Gibbs, G. V.; American Mineralogist 56 (1971) 791–823; doi:

data_9000239
_publ_section_title
;
 The crystal chemistry of the silicate garnets
 sample An
;
_journal_name_full               'American Mineralogist'
_journal_page_first              791
_journal_page_last               823
_journal_volume                  56
_journal_year                    1971
_chemical_compound_source        'Valmalen, Italy'
_chemical_formula_sum            'Ca3 Fe2 O12 Si3'
_chemical_name_mineral           Andradite
_space_group_IT_number           230
_symmetry_space_group_name_Hall  '-I 4bd 2c 3'
_symmetry_space_group_name_H-M   'I a -3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.058
_cell_length_b                   12.058
_cell_length_c                   12.058
_cell_volume                     1753.177
_database_code_amcsd             0000246
_exptl_crystal_density_diffrn    3.851
_cod_original_formula_sum        'Si3 Fe2 Ca3 O12'
_cod_database_code               9000239
Cation distribution and atomic thermal vibrations in an iron-rich orthopyroxene
Burnham, C. W.; Ohashi, Y.; Hafner, S. S.; Virgo, D.; American Mineralogist 56 (1971) 850–876; doi:

data_9000240
_publ_section_title
;Cation distribution and atomic thermal vibrations in an iron-rich
 orthopyroxene
;
_journal_name_full               'American Mineralogist'
_journal_page_first              850
_journal_page_last               876
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'Ca0.04 Fe1.71 Mg0.25 O6 Si2'
_chemical_name_mineral           Ferrosilite
_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_length_a                   18.405
_cell_length_b                   9.0338
_cell_length_c                   5.2390
_cell_formula_units_Z            8
_cell_volume                     871.073
_database_code_amcsd             0000247
_exptl_crystal_density_diffrn    3.894
_cod_original_formula_sum        'Si2 Fe1.71 Mg.25 Ca.04 O6'
_cod_database_code               9000240
Crystal chemistry of a lunar pigeonite class b data refinement
Clark, J. R.; Ross, M.; Appleman, D. E.; American Mineralogist 56 (1971) 888–908; doi:

data_9000241
_publ_section_title
;
 Crystal chemistry of a lunar pigeonite
 class b data refinement
;
_journal_name_full               'American Mineralogist'
_journal_page_first              888
_journal_page_last               908
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'Fe0.46 Mg0.54 O3 Si'
_chemical_name_mineral           Pigeonite
_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                 108.71
_cell_angle_gamma                90
_cell_length_a                   9.678
_cell_length_b                   8.905
_cell_length_c                   5.227
_cell_formula_units_Z            8
_cell_volume                     426.671
_database_code_amcsd             0000248
_exptl_crystal_density_diffrn    3.577
_cod_original_formula_sum        '(Mg.54 Fe.46) Si O3'
_cod_database_code               9000241
The crystal structure of legrandite
McLean, W. J.; Anthony, J. W.; Finney, J. J.; Laughon, R. B.; American Mineralogist 56 (1971) 1147–1154; doi:

data_9000242
_publ_section_title
;
 The crystal structure of legrandite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1147
_journal_page_last               1154
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'As O6 Zn2'
_chemical_name_mineral           Legrandite
_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                 104.388
_cell_angle_gamma                90
_cell_length_a                   12.805
_cell_length_b                   7.933
_cell_length_c                   10.215
_cell_formula_units_Z            8
_cell_volume                     1005.115
_database_code_amcsd             0000249
_exptl_crystal_density_diffrn    3.987
_cod_original_formula_sum        'As Zn2 O6'
_cod_database_code               9000242
Crystal structures of the humite minerals: III. Mg/Fe ordering in humite and its relation to other ferromagnesian silicates
Ribbe, P. H.; Gibbs, G. V.; American Mineralogist 56 (1971) 1155–1173; doi:

data_9000243
_publ_section_title
;Crystal structures of the humite minerals: III. Mg/Fe ordering in humite and
 its relation to other ferromagnesian silicates
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1155
_journal_page_last               1173
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'F Fe0.399 H Mg6.601 O13 Si3'
_chemical_name_mineral           Humite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.7408
_cell_length_b                   10.2580
_cell_length_c                   20.8526
_cell_volume                     1014.085
_database_code_amcsd             0000250
_exptl_crystal_density_diffrn    3.242
_cod_original_formula_sum        '(Mg6.601 Fe.399) Si3 O13 (F H)'
_cod_database_code               9000243
The crystal structure of nasonite
Giuseppetti, G.; Rossi, G.; Tadini, C.; American Mineralogist 56 (1971) 1174–1179; doi:

data_9000244
_publ_section_title
;
 The crystal structure of nasonite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1174
_journal_page_last               1179
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'Ca4 Cl2 O21 Pb6 Si6'
_chemical_name_mineral           Nasonite
_space_group_IT_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_length_a                   10.08
_cell_length_b                   10.08
_cell_length_c                   13.27
_cell_formula_units_Z            2
_cell_volume                     1167.677
_database_code_amcsd             0000251
_exptl_crystal_density_diffrn    5.628
_cod_original_formula_sum        'Pb6 Ca4 Cl2 Si6 O21'
_cod_database_code               9000244
Refinement of the crystal structure of apophyllite I. X-ray diffraction and physical properties
Colville, A. A.; Anderson, C. P.; Black, P. M.; American Mineralogist 56 (1971) 1222–1233; doi:

data_9000245
_publ_section_title
;
 Refinement of the crystal structure of apophyllite I. X-ray diffraction and
 physical properties
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1222
_journal_page_last               1233
_journal_volume                  56
_journal_year                    1971
_chemical_compound_source
'Phoenix mine, Keweenaw Peninsula, Michigan, USA'
_chemical_formula_sum            'Ca4 F H16 K0.84 Na0.16 O28 Si8'
_chemical_name_mineral           Fluorapophyllite
_space_group_IT_number           128
_symmetry_space_group_name_Hall  '-P 4 2n'
_symmetry_space_group_name_H-M   'P 4/m n c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.963
_cell_length_b                   8.963
_cell_length_c                   15.804
_cell_volume                     1269.620
_database_code_amcsd             0000252
_exptl_crystal_density_diffrn    2.366
_cod_original_formula_sum        '(K.84 Na.16) Ca4 Si8 O28 F H16'
_cod_database_code               9000245
The refinement of the crystal structure of apophyllite II. Determination of the hydrogen positions by X-ray diffraction Note: O1-B23 changed to match symmetry constraints
Chao G Y; American Mineralogist 56 (1971) 1234–1242; doi:

data_9000246
_publ_section_title
;The refinement of the crystal structure of apophyllite II. Determination of
 the hydrogen positions by X-ray diffraction Note: O1-B23 changed to match
 symmetry constraints
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1234
_journal_page_last               1242
_journal_volume                  56
_journal_year                    1971
_chemical_compound_source        'Mont. St. Hilaire, Quebec, Canada'
_chemical_formula_sum            'Ca4 F H16 K O28 Si8'
_chemical_name_mineral           Fluorapophyllite
_space_group_IT_number           128
_symmetry_space_group_name_Hall  '-P 4 2n'
_symmetry_space_group_name_H-M   'P 4/m n c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.965
_cell_length_b                   8.965
_cell_length_c                   15.767
_cell_formula_units_Z            2
_cell_volume                     1267.213
_database_code_amcsd             0000256
_exptl_crystal_density_diffrn    2.378
_cod_original_formula_sum        'K Ca4 Si8 O28 F H16'
_cod_database_code               9000246
Refinement of the crystal structure of apophyllite III. Determination of the hydrogen positions by neutron diffraction
Prince E; American Mineralogist 56 (1971) 1243–1251; doi:

data_9000247
_publ_section_title
;
 Refinement of the crystal structure of apophyllite III. Determination of the
 hydrogen positions by neutron diffraction
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1243
_journal_page_last               1251
_journal_volume                  56
_journal_year                    1971
_chemical_compound_source        'Centerville, Virginia, USA'
_chemical_formula_sum            'Ca4 F H16 K O28 Si8'
_chemical_name_mineral           Fluorapophyllite
_space_group_IT_number           128
_symmetry_space_group_name_Hall  '-P 4 2n'
_symmetry_space_group_name_H-M   'P 4/m n c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.96
_cell_length_b                   8.96
_cell_length_c                   15.80
_cell_formula_units_Z            2
_cell_volume                     1268.449
_database_code_amcsd             0000257
_exptl_crystal_density_diffrn    2.375
_cod_original_formula_sum        'K Ca4 Si8 O28 F H16'
_cod_database_code               9000247
A novel face-sharing octahedral trimer in the crystal structure of seamanite
Moore, P. B.; Ghose, S.; American Mineralogist 56 (1971) 1527–1538; doi:

data_9000248
_publ_section_title
;
 A novel face-sharing octahedral trimer in the crystal structure of seamanite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1527
_journal_page_last               1538
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'B H6 Mn3 O10 P'
_chemical_name_mineral           Seamanite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.811
_cell_length_b                   15.114
_cell_length_c                   6.691
_cell_volume                     789.909
_database_code_amcsd             0000258
_exptl_crystal_density_diffrn    3.133
_cod_original_formula_sum        'Mn3 P B (O10 H6)'
_cod_database_code               9000248
Crystal chemistry of the basic manganese arsenates: V. Mixed manganese coordination in the atomic arrangement of arsenoclasite
Moore, P. B.; Molin-Case J; American Mineralogist 56 (1971) 1539–1552; doi:

data_9000249
_publ_section_title
;
 Crystal chemistry of the basic manganese arsenates: V. Mixed manganese
 coordination in the atomic arrangement of arsenoclasite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1539
_journal_page_last               1552
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'As2 H4 Mn5 O12'
_chemical_name_mineral           Arsenoclasite
_space_group_IT_number           19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   18.29
_cell_length_b                   5.75
_cell_length_c                   9.31
_cell_volume                     979.109
_database_code_amcsd             0000259
_exptl_crystal_density_diffrn    4.210
_cod_original_cell_volume        979.110
_cod_original_formula_sum        'Mn5 As2 (O12 H4)'
_cod_database_code               9000249
The crystal structure of aksaite
Dal Negro, A.; Ungaretti, L.; Sabelli, C.; American Mineralogist 56 (1971) 1553–1566; doi:

data_9000250
_publ_section_title
;
 The crystal structure of aksaite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1553
_journal_page_last               1566
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'B6 H9 Mg O15'
_chemical_name_mineral           Aksaite
_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                   12.540
_cell_length_b                   24.327
_cell_length_c                   7.480
_cell_volume                     2281.853
_database_code_amcsd             0000260
_exptl_crystal_density_diffrn    1.969
_cod_original_formula_sum        'Mg B6 O15 H9'
_cod_database_code               9000250
Crystal structures and mineral chemistry of hydrated ferric sulphates: II. The crystal structure of paracoquimbite
Robinson, P. D.; Fang, J. H.; American Mineralogist 56 (1971) 1567–1572; doi:

data_9000251
_publ_section_title
;Crystal structures and mineral chemistry of hydrated ferric sulphates: II.
 The crystal structure of paracoquimbite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1567
_journal_page_last               1572
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'Fe2 H9 O21 S3'
_chemical_name_mineral           Paracoquimbite
_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_formula_units_Z            12
_cell_length_a                   10.926
_cell_length_b                   10.926
_cell_length_c                   51.300
_cell_volume                     5303.595
_database_code_amcsd             0000261
_exptl_crystal_density_diffrn    2.078
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe2 S3 O21 H9'
_cod_database_code               9000251
The crystal structure of the low-temperature form of silver selenide
Wiegers, G. A.; American Mineralogist 56 (1971) 1882–1888; doi:

data_9000252
_publ_section_title
;
 The crystal structure of the low-temperature form of silver selenide
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1882
_journal_page_last               1888
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'Ag2 Se'
_chemical_name_mineral           Naumannite
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.333
_cell_length_b                   7.062
_cell_length_c                   7.764
_cell_formula_units_Z            4
_cell_volume                     237.576
_database_code_amcsd             0000262
_exptl_crystal_density_diffrn    8.239
_cod_database_code               9000252
The crystal structure of the low-temperature form of silver selenide
Wiegers, G. A.; American Mineralogist 56 (1971) 1882–1888; doi:

data_9000253
_publ_section_title
;
 The crystal structure of the low-temperature form of silver selenide
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1882
_journal_page_last               1888
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'Ag2 S'
_chemical_name_mineral           Acanthite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 99.61
_cell_angle_gamma                90
_cell_length_a                   4.229
_cell_length_b                   6.931
_cell_length_c                   7.862
_cell_formula_units_Z            4
_cell_volume                     227.211
_exptl_crystal_density_diffrn    7.244
_cod_data_source_file            cifdata.txt
_cod_data_source_block           'global_262'
_cod_database_code               9000253
The crystal structures of yavapaiite, KFe(SO4)2, and goldichite, KFe(SO4)2.4H2O
Graeber, E. J.; Rosenzweig, A.; American Mineralogist 56 (1971) 1917–1933; doi:

data_9000254
_publ_section_title
;The crystal structures of yavapaiite, KFe(SO4)2, and goldichite,
 KFe(SO4)2.4H2O
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1917
_journal_page_last               1933
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'Fe K O8 S2'
_chemical_name_mineral           Yavapaiite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 94.90
_cell_angle_gamma                90
_cell_length_a                   8.152
_cell_length_b                   5.153
_cell_length_c                   7.877
_cell_formula_units_Z            2
_cell_volume                     329.682
_database_code_amcsd             0000263
_exptl_crystal_density_diffrn    2.892
_cod_original_formula_sum        'Fe K S2 O8'
_cod_database_code               9000254
The crystal structures of yavapaiite, KFe(SO4)2, and goldichite, KFe(SO4)2.4H2O
Graeber, E. J.; Rosenzweig, A.; American Mineralogist 56 (1971) 1917–1933; doi:

data_9000255
_publ_section_title
;The crystal structures of yavapaiite, KFe(SO4)2, and goldichite,
 KFe(SO4)2.4H2O
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1917
_journal_page_last               1933
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'Fe H8 K O12 S2'
_chemical_name_mineral           Goldichite
_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                 101.68
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.387
_cell_length_b                   10.486
_cell_length_c                   9.086
_cell_volume                     969.138
_database_code_amcsd             0000264
_exptl_crystal_density_diffrn    2.461
_cod_original_formula_sum        'Fe K S2 O12 H8'
_cod_database_code               9000255
Veatchite: Crystal structure and correlations with p-veatchite
Clark, J. R.; Christ, C. L.; American Mineralogist 56 (1971) 1934–1954; doi:

data_9000256
_publ_section_title
;
 Veatchite: Crystal structure and correlations with p-veatchite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1934
_journal_page_last               1954
_journal_volume                  56
_journal_year                    1971
_chemical_formula_sum            'B11 H7 O22 Sr2'
_chemical_name_mineral           Veatchite
_space_group_IT_number           9
_symmetry_space_group_name_Hall  'A -2ya'
_symmetry_space_group_name_H-M   'A 1 a 1'
_cell_angle_alpha                90
_cell_angle_beta                 92.10
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   20.860
_cell_length_b                   11.738
_cell_length_c                   6.652
_cell_volume                     1627.679
_exptl_crystal_density_diffrn    2.666
_cod_original_formula_sum        'Sr2 B11 O22 H7'
_cod_database_code               9000256
_database_code_amcsd 0000265