LMucko/crystallography-open-database huggingface dataset:
Crystal structure of a Cr-bearing pyroxene Sample: Mg1.4Cr.6Si2O6
Angel, R. J.; Gasparik, T.; Finger, L. W.; American Mineralogist 74 (1989) 599–603; doi:

data_9001220
_publ_section_title
;
 Crystal structure of a Cr-bearing pyroxene
 Sample: Mg1.4Cr.6Si2O6
;
_journal_name_full               'American Mineralogist'
_journal_page_first              599
_journal_page_last               603
_journal_volume                  74
_journal_year                    1989
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Cr0.306 Mg0.712 O3 Si0.982'
_chemical_name_mineral           Enstatite
_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                 109.41
_cell_angle_gamma                90
_cell_length_a                   9.713
_cell_length_b                   8.910
_cell_length_c                   5.238
_cell_formula_units_Z            8
_cell_volume                     427.547
_database_code_amcsd             0001244
_exptl_crystal_density_diffrn    3.380
_cod_original_formula_sum        'Mg.712 Cr.306 Si.982 O3'
_cod_database_code               9001220
Iron distribution in staurolite at room and low temperatures sample at room temperature
Alexander, V. D.; American Mineralogist 74 (1989) 610–619; doi:

data_9001221
_publ_section_title
;
 Iron distribution in staurolite at room and low temperatures
 sample at room temperature
;
_journal_name_full               'American Mineralogist'
_journal_page_first              610
_journal_page_last               619
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum
'Al4.499 Fe0.581 H Mg0.233 Mn0.02 O12 Si1.804 Ti0.022 Zn0.163'
_chemical_name_mineral           Staurolite
_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                 90.38
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.865
_cell_length_b                   16.580
_cell_length_c                   5.668
_cell_volume                     739.101
_database_code_amcsd             0001245
_exptl_crystal_density_diffrn    3.738
_cod_original_formula_sum
'Fe.581 Mg.233 Zn.163 Ti.022 Al4.499 Si1.804 Mn.02 O12 H'
_cod_database_code               9001221
Iron distribution in staurolite at room and low temperatures sample at low temperature (liquid N2)
Alexander, V. D.; American Mineralogist 74 (1989) 610–619; doi:

data_9001222
_publ_section_title
;
 Iron distribution in staurolite at room and low temperatures
 sample at low temperature (liquid N2)
;
_journal_name_full               'American Mineralogist'
_journal_page_first              610
_journal_page_last               619
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum
'Al4.499 Fe0.581 H Mg0.233 Mn0.02 O12 Si1.804 Ti0.022 Zn0.163'
_chemical_name_mineral           Staurolite
_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                 90.39
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.871
_cell_length_b                   16.587
_cell_length_c                   5.661
_cell_volume                     739.062
_database_code_amcsd             0001246
_exptl_crystal_density_diffrn    3.738
_cod_original_formula_sum
'Al4.499 Ti.022 Zn.163 Mg.233 Fe.581 Si1.804 Mn.02 O12 H'
_cod_database_code               9001222
Kornerupine: Chemical crystallography, comparative crystallography, and its cation relation to olivine and to Ni2In intermetallic
Moore, P. B.; Sen Gupta, P. K.; Schlemper, E. O.; American Mineralogist 74 (1989) 642–655; doi:

data_9001223
_publ_section_title
;
 Kornerupine: Chemical crystallography, comparative crystallography, and its
 cation relation to olivine and to Ni2In intermetallic
;
_journal_name_full               'American Mineralogist'
_journal_page_first              642
_journal_page_last               655
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Al6.088 B0.428 Fe0.38 H Mg3.374 O22 Si4.104'
_chemical_name_mineral           Kornerupine
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   16.041
_cell_length_b                   13.746
_cell_length_c                   6.715
_cell_volume                     1480.655
_database_code_amcsd             0001247
_exptl_crystal_density_diffrn    3.321
_cod_original_formula_sum        'Mg3.374 Al6.088 Fe.38 Si4.104 B.428 O22 H'
_cod_database_code               9001223
Geigerite, the Mn analogue of chudobaite: Its description and crystal structure
Graeser, S.; Schwander, H.; Bianchi, R.; Pilati, T.; Gramaccioli, C. M.; American Mineralogist 74 (1989) 676–684; doi:

data_9001224
_publ_section_title
;Geigerite, the Mn analogue of chudobaite: Its description and crystal
 structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              676
_journal_page_last               684
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'As4 H22 Mn5 O26'
_chemical_name_mineral           Geigerite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                80.97
_cell_angle_beta                 84.20
_cell_angle_gamma                81.85
_cell_length_a                   7.944
_cell_length_b                   10.691
_cell_length_c                   6.770
_cell_formula_units_Z            1
_cell_volume                     560.281
_database_code_amcsd             0001248
_exptl_crystal_density_diffrn    3.001
_cod_original_formula_sum        'As4 Mn5 O26 H22'
_cod_database_code               9001224
Effects of oxidation-dehydrogenation in tschermakitic hornblende sample H-1, natural
Phillips, M. W.; Draheim, J. E.; Popp, R. K.; Clowe, C. A.; Pinkerton, A. A.; American Mineralogist 74 (1989) 764–773; doi:

data_9001225
_publ_section_title
;
 Effects of oxidation-dehydrogenation in tschermakitic hornblende
 sample H-1, natural
;
_journal_name_full               'American Mineralogist'
_journal_page_first              764
_journal_page_last               773
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum
'Al2.42 Ca1.802 Fe1.846 H2 Mg2.224 Na0.628 O24 Si6.44 Ti0.07'
_chemical_name_mineral           Hornblende
_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                 104.97
_cell_angle_gamma                90
_cell_length_a                   9.813
_cell_length_b                   18.055
_cell_length_c                   5.321
_cell_formula_units_Z            2
_cell_volume                     910.746
_database_code_amcsd             0001249
_exptl_crystal_density_diffrn    3.207
_cod_original_formula_sum
'Al2.42 Si6.44 Fe1.846 Mg2.224 Ti.07 Ca1.802 Na.628 O24 H2'
_cod_database_code               9001225
Effects of oxidation-dehydrogenation in tschermakitic hornblende sample H-11, after annealing at 650 C, 1 kbar
Phillips, M. W.; Draheim, J. E.; Popp, R. K.; Clowe, C. A.; Pinkerton, A. A.; American Mineralogist 74 (1989) 764–773; doi:

data_9001226
_publ_section_title
;
 Effects of oxidation-dehydrogenation in tschermakitic hornblende
 sample H-11, after annealing at 650 C, 1 kbar
;
_journal_name_full               'American Mineralogist'
_journal_page_first              764
_journal_page_last               773
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum
'Al2.42 Ca1.806 Fe1.884 H1.78 Mg2.186 Na0.664 O24 Si6.44 Ti0.07'
_chemical_name_mineral           Hornblende
_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                 105.05
_cell_angle_gamma                90
_cell_length_a                   9.803
_cell_length_b                   18.046
_cell_length_c                   5.313
_cell_formula_units_Z            2
_cell_volume                     907.657
_database_code_amcsd             0001250
_exptl_crystal_density_diffrn    3.225
_exptl_crystal_pressure_history  'after annealing at 650 C, 1 kbar'
_exptl_crystal_thermal_history   'after annealing at 650 C'
_cod_original_formula_sum
'Al2.42 Si6.44 Fe1.884 Mg2.186 Ti.07 Ca1.806 Na.664 O24 H1.78'
_cod_database_code               9001226
Effects of oxidation-dehydrogenation in tschermakitic hornblende sample H-3, after annealing at 700 C
Phillips, M. W.; Draheim, J. E.; Popp, R. K.; Clowe, C. A.; Pinkerton, A. A.; American Mineralogist 74 (1989) 764–773; doi:

data_9001227
_publ_section_title
;
 Effects of oxidation-dehydrogenation in tschermakitic hornblende
 sample H-3, after annealing at 700 C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              764
_journal_page_last               773
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum
'Al2.42 Ca1.83 Fe1.852 H1.34 Mg2.218 Na0.706 O24 Si6.44 Ti0.07'
_chemical_name_mineral           Hornblende
_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                 105.09
_cell_angle_gamma                90
_cell_length_a                   9.786
_cell_length_b                   18.024
_cell_length_c                   5.306
_cell_formula_units_Z            2
_cell_volume                     903.616
_database_code_amcsd             0001251
_exptl_crystal_density_diffrn    3.241
_exptl_crystal_thermal_history   'after annealing at 700 C'
_cod_original_formula_sum
'Al2.42 Si6.44 Fe1.852 Mg2.218 Ti.07 Ca1.83 Na.706 O24 H1.34'
_cod_database_code               9001227
OH substitution in garnets: X-ray and neutron diffraction, infrared, and geometric-modeling studies sample SB-1
Lager, G. A.; Armbruster, T.; Rotella, F. J.; Rossman, G. R.; American Mineralogist 74 (1989) 840–851; doi:

data_9001228
_publ_section_title
;
 OH substitution in garnets: X-ray and neutron diffraction, infrared, and
 geometric-modeling studies
 sample SB-1
;
_journal_name_full               'American Mineralogist'
_journal_page_first              840
_journal_page_last               851
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Al0.318 Ca3 Fe1.682 O12 Si2.88'
_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_length_a                   12.057
_cell_length_b                   12.057
_cell_length_c                   12.057
_cell_formula_units_Z            8
_cell_volume                     1752.741
_database_code_amcsd             0001252
_exptl_crystal_density_diffrn    3.756
_cod_original_formula_sum        'Ca3 (Fe1.682 Al.318) Si2.88 O12'
_cod_database_code               9001228
OH substitution in garnets: X-ray and neutron diffraction, infrared, and geometric-modeling studies sample SB-2
Lager, G. A.; Armbruster, T.; Rotella, F. J.; Rossman, G. R.; American Mineralogist 74 (1989) 840–851; doi:

data_9001229
_publ_section_title
;
 OH substitution in garnets: X-ray and neutron diffraction, infrared, and
 geometric-modeling studies
 sample SB-2
;
_journal_name_full               'American Mineralogist'
_journal_page_first              840
_journal_page_last               851
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Al0.496 Ca3 Fe1.504 O12 Si2.745'
_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_length_a                   12.085
_cell_length_b                   12.085
_cell_length_c                   12.085
_cell_formula_units_Z            8
_cell_volume                     1764.981
_database_code_amcsd             0001253
_exptl_crystal_density_diffrn    3.663
_cod_original_formula_sum        'Ca3 (Fe1.504 Al.496) Si2.745 O12'
_cod_database_code               9001229
OH substitution in garnets: X-ray and neutron diffraction, infrared, and geometric-modeling studies sample SB-3
Lager, G. A.; Armbruster, T.; Rotella, F. J.; Rossman, G. R.; American Mineralogist 74 (1989) 840–851; doi:

data_9001230
_publ_section_title
;
 OH substitution in garnets: X-ray and neutron diffraction, infrared, and
 geometric-modeling studies
 sample SB-3
;
_journal_name_full               'American Mineralogist'
_journal_page_first              840
_journal_page_last               851
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Al0.404 Ca3 Fe1.596 O12 Si2.58'
_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_length_a                   12.106
_cell_length_b                   12.106
_cell_length_c                   12.106
_cell_formula_units_Z            8
_cell_volume                     1774.198
_database_code_amcsd             0001254
_exptl_crystal_density_diffrn    3.629
_cod_original_formula_sum        'Ca3 (Fe1.596 Al.404) Si2.58 O12'
_cod_database_code               9001230
OH substitution in garnets: X-ray and neutron diffraction, infrared, and geometric-modeling studies
Lager, G. A.; Armbruster, T.; Rotella, F. J.; Rossman, G. R.; American Mineralogist 74 (1989) 840–851; doi:

data_9001231
_publ_section_title
;
 OH substitution in garnets: X-ray and neutron diffraction, infrared, and
 geometric-modeling studies
;
_journal_name_full               'American Mineralogist'
_journal_page_first              840
_journal_page_last               851
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Al2 Ca3 D2.796 O12 Si2.301'
_chemical_name_mineral           'Hibschite (deuterated)'
_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                   12.010
_cell_length_b                   12.010
_cell_length_c                   12.010
_cell_formula_units_Z            8
_cell_volume                     1732.324
_exptl_crystal_density_diffrn    3.347
_cod_original_formula_sum        'Ca3 Al2 Si2.301 O12 D2.796'
_cod_database_code               9001231
_database_code_amcsd 0001255
Structural variations in natural F, OH, and Cl apatites Locality: Durango Mexico
Hughes J M; Cameron M; Crowley K D; American Mineralogist 74 (1989) 870–876; doi:

data_9001232
_publ_section_title
;
 Structural variations in natural F, OH, and Cl apatites
 Locality: Durango Mexico
;
_journal_name_full               'American Mineralogist'
_journal_page_first              870
_journal_page_last               876
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Ca5 F O12 P3'
_chemical_name_mineral           Fluorapatite
_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                   9.3973
_cell_length_b                   9.3973
_cell_length_c                   6.8782
_cell_formula_units_Z            2
_cell_volume                     526.031
_cod_original_formula_sum        'Ca5 P3 O12 F'
_cod_database_code               9001232
_database_code_amcsd 0001256
Structural variations in natural F, OH, and Cl apatites Locality: Holly Springs, Georgia, USA
Hughes J M; Cameron M; Crowley K D; American Mineralogist 74 (1989) 870–876; doi:

data_9001233
_publ_section_title
;
 Structural variations in natural F, OH, and Cl apatites
 Locality: Holly Springs, Georgia, USA
;
_journal_name_full               'American Mineralogist'
_journal_page_first              870
_journal_page_last               876
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Ca5 H O13 P3'
_chemical_name_mineral           Hydroxylapatite
_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                   9.4166
_cell_length_b                   9.4166
_cell_length_c                   6.8745
_cell_formula_units_Z            2
_cell_volume                     527.910
_cod_original_formula_sum        'Ca5 P3 O13 H'
_cod_database_code               9001233
_database_code_amcsd 0001257
Structural variations in natural F, OH, and Cl apatites Locality: Kragero, Norway
Hughes J M; Cameron M; Crowley K D; American Mineralogist 74 (1989) 870–876; doi:

data_9001234
_publ_section_title
;
 Structural variations in natural F, OH, and Cl apatites
 Locality: Kragero, Norway
;
_journal_name_full               'American Mineralogist'
_journal_page_first              870
_journal_page_last               876
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Ca5 Cl0.88 F0.12 O12 P3'
_chemical_name_mineral           Chlorapatite
_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                   9.598
_cell_length_b                   9.598
_cell_length_c                   6.776
_cell_formula_units_Z            2
_cell_volume                     540.587
_cod_original_formula_sum        'Ca5 P3 O12 Cl.88 F.12'
_cod_database_code               9001234
_database_code_amcsd 0001258
Rietveld refinement of the coronadite structure sample from Morocco
Post, J. E.; Bish, D. L.; American Mineralogist 74 (1989) 913–917; doi:

data_9001235
_publ_section_title
;
 Rietveld refinement of the coronadite structure
 sample from Morocco
;
_journal_name_full               'American Mineralogist'
_journal_page_first              913
_journal_page_last               917
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Mn2 O4 Pb0.268'
_chemical_name_mineral           Coronadite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-I 2y'
_symmetry_space_group_name_H-M   'I 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.39
_cell_angle_gamma                90
_cell_length_a                   9.938
_cell_length_b                   2.8678
_cell_length_c                   9.834
_cell_formula_units_Z            4
_cell_volume                     280.264
_database_code_amcsd             0001262
_exptl_crystal_density_diffrn    5.437
_cod_original_formula_sum        'Mn2 Pb.268 O4'
_cod_database_code               9001235
Rietveld refinement of the coronadite structure sample from Broken Hill
Post, J. E.; Bish, D. L.; American Mineralogist 74 (1989) 913–917; doi:

data_9001236
_publ_section_title
;
 Rietveld refinement of the coronadite structure
 sample from Broken Hill
;
_journal_name_full               'American Mineralogist'
_journal_page_first              913
_journal_page_last               917
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Mn2 O4 Pb0.35'
_chemical_name_mineral           Coronadite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-I 2y'
_symmetry_space_group_name_H-M   'I 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.20
_cell_angle_gamma                90
_cell_length_a                   9.913
_cell_length_b                   2.8652
_cell_length_c                   9.843
_cell_formula_units_Z            4
_cell_volume                     279.566
_database_code_amcsd             0001263
_exptl_crystal_density_diffrn    5.854
_cod_original_formula_sum        'Mn2 Pb.35 O4'
_cod_database_code               9001236
BaCuSi2O6: a new cyclosilicate with four-membered tetrahedral rings
Finger, L. W.; Hazen, R. M.; Hemley, R. J.; American Mineralogist 74 (1989) 952–955; doi:

data_9001237
_publ_section_title
;
 BaCuSi2O6: a new cyclosilicate with four-membered tetrahedral rings
;
_journal_name_full               'American Mineralogist'
_journal_page_first              952
_journal_page_last               955
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Ba Cu O6 Si2'
_chemical_name_mineral           BaCuSi2O6
_space_group_IT_number           119
_symmetry_space_group_name_Hall  'I -4 -2'
_symmetry_space_group_name_H-M   'I -4 m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.042
_cell_length_b                   7.042
_cell_length_c                   11.133
_cell_formula_units_Z            4
_cell_volume                     552.083
_database_code_amcsd             0001264
_exptl_crystal_density_diffrn    4.247
_cod_original_formula_sum        'Ba Cu Si2 O6'
_cod_database_code               9001237
_amcsd_formula_title             BaCuSi2O6
Crystal chemistry of a nonstoichiometric carpholite, Kx(Mn2-x,Lix)Al4Si4O12(OH)4F4: A chain silicate related to pyroxenes Locality: Sawtooth batholith, Idaho, USA
Ghose, S.; Sen Gupta, P. K.; Boggs, R. C.; Schlemper, E. O.; American Mineralogist 74 (1989) 1084–1090; doi:

data_9001238
_publ_section_title
;
 Crystal chemistry of a nonstoichiometric carpholite,
 Kx(Mn2-x,Lix)Al4Si4O12(OH)4F4: A chain silicate related to pyroxenes
 Locality: Sawtooth batholith, Idaho, USA
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1084
_journal_page_last               1090
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Al4 F2 H2 K0.65 Li0.336 Mn1.35 O8 Si2'
_chemical_name_mineral           Carpholite
_space_group_IT_number           68
_symmetry_space_group_name_Hall  'C 2 2 -1ac'
_symmetry_space_group_name_H-M   'C c c b :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   13.715
_cell_length_b                   20.302
_cell_length_c                   5.138
_cell_volume                     1430.635
_exptl_crystal_density_diffrn    4.030
_cod_original_sg_symbol_H-M      'C c c a'
_cod_original_formula_sum        'K.65 Mn1.35 Li.336 Al4 Si2 O8 F2 H2'
_cod_database_code               9001238