LMucko/crystallography-open-database huggingface dataset:
The crystal structure of bartonite, a potassium iron sulfide, and its relationship to pentlandite and djerfisherite
Evans, H. T.; Clark, J. R.; American Mineralogist 66 (1981) 376–384; doi:

data_9000810
_publ_section_title
;
 The crystal structure of bartonite, a potassium iron sulfide, and its
 relationship to pentlandite and djerfisherite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              376
_journal_page_last               384
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Fe6.789 K1.893 S8.975'
_chemical_name_mineral           Bartonite
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   10.424
_cell_length_b                   10.424
_cell_length_c                   20.626
_cell_formula_units_Z            6
_cell_volume                     2241.217
_database_code_amcsd             0000824
_exptl_crystal_density_diffrn    3.294
_cod_original_cell_volume        2241.216
_cod_original_formula_sum        'K1.893 Fe6.789 S8.975'
_cod_database_code               9000810
The crystal structure of picropharmacolite, Ca4Mg(HAsO4)2(AsO4)2*11H2O
Catti, M.; Ferraris, G.; Ivaldi, G.; American Mineralogist 66 (1981) 385–391; doi:

data_9000811
_publ_section_title
;
 The crystal structure of picropharmacolite, Ca4Mg(HAsO4)2(AsO4)2*11H2O
;
_journal_name_full               'American Mineralogist'
_journal_page_first              385
_journal_page_last               391
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'As4 Ca4 H24 Mg O27'
_chemical_name_mineral           Picropharmacolite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                99.85
_cell_angle_beta                 96.41
_cell_angle_gamma                91.60
_cell_formula_units_Z            2
_cell_length_a                   13.547
_cell_length_b                   13.500
_cell_length_c                   6.710
_cell_volume                     1200.121
_database_code_amcsd             0000825
_exptl_crystal_density_diffrn    2.603
_cod_original_formula_sum        'As4 Ca4 Mg O27 H24'
_cod_database_code               9000811
The crystal structure of synthetic chukhrovite, Ca4AlSi(SO4)F13*12H2O
Mathew M; Takagi S; Waerstad K R; Frazier A W; American Mineralogist 66 (1981) 392–397; doi:

data_9000812
_publ_section_title
;
 The crystal structure of synthetic chukhrovite, Ca4AlSi(SO4)F13*12H2O
;
_journal_name_full               'American Mineralogist'
_journal_page_first              392
_journal_page_last               397
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Al Ca4 F13 H24 O16 S Si'
_chemical_name_mineral           Chukhrovite
_space_group_IT_number           203
_symmetry_space_group_name_Hall  '-F 2uv 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   16.710
_cell_length_b                   16.710
_cell_length_c                   16.710
_cell_volume                     4665.833
_cod_original_sg_symbol_H-M      'F d 3'
_cod_original_formula_sum        'Ca4 (Si Al) S O16 F13 H24'
_cod_database_code               9000812
_database_code_amcsd 0000826
Hydrothermal synthesis of nukundamite and its crystal structure
Sugaki, A.; Shima, H.; Kitakaze, A.; Mizota, T.; American Mineralogist 66 (1981) 398–402; doi:

data_9000813
_publ_section_title
;
 Hydrothermal synthesis of nukundamite and its crystal structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              398
_journal_page_last               402
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Cu0.848 Fe0.152 S'
_chemical_name_mineral           Nukundamite
_space_group_IT_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_length_a                   3.7830
_cell_length_b                   3.7830
_cell_length_c                   11.1950
_cell_formula_units_Z            4
_cell_volume                     138.748
_database_code_amcsd             0000828
_exptl_crystal_density_diffrn    4.521
_cod_original_formula_sum        '(Cu.848 Fe.152) S'
_cod_database_code               9000813
Natroapophyllite, a new orthorhombic sodium analog of apophyllite II. Crystal structure
Miura Y; Kato T; Rucklidge J C; Matsueda H; American Mineralogist 66 (1981) 410–423; doi:

data_9000814
_publ_section_title
;
 Natroapophyllite, a new orthorhombic sodium analog of apophyllite
 II. Crystal structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              410
_journal_page_last               423
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Ca4 F H16 Na O28 Si8'
_chemical_name_mineral           Natroapophyllite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.875
_cell_length_b                   8.881
_cell_length_c                   15.79
_cell_formula_units_Z            2
_cell_volume                     1244.550
_cod_original_formula_sum        'Si8 Ca4 Na F O28 H16'
_cod_database_code               9000814
_database_code_amcsd 0000830
The crystal structure of a Mexican axinite
Swinnea J S; Steinfink H; Rendon-DiazMiron L E; Enciso de la Vega S; American Mineralogist 66 (1981) 428–431; doi:

data_9000815
_publ_section_title
;
 The crystal structure of a Mexican axinite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              428
_journal_page_last               431
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum
'Al1.893 B Ca2 Fe0.657 H K0.022 Mg0.185 Mn0.13 Na0.065 O16 Si4 Ti0.005'
_chemical_name_mineral           Ferroaxinite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                91.857
_cell_angle_beta                 98.188
_cell_angle_gamma                77.359
_cell_length_a                   7.1437
_cell_length_b                   9.1898
_cell_length_c                   8.9529
_cell_formula_units_Z            2
_cell_volume                     567.657
_cod_original_formula_sum
'Ca2 Fe.657 Mn.13 Mg.185 Ti.005 K.022 Na.065 Al1.893 B H Si4 O16'
_cod_database_code               9000815
_database_code_amcsd 0000831
Refinement of the crystal structure of kanonaite, (Mn,Al)(Al,Mn)O[SiO4]
Weiss, Z.; Bailey, S. W.; Rieder, M.; American Mineralogist 66 (1981) 561–567; doi:

data_9000816
_publ_section_title
;
 Refinement of the crystal structure of kanonaite, (Mn,Al)(Al,Mn)O[SiO4]
;
_journal_name_full               'American Mineralogist'
_journal_page_first              561
_journal_page_last               567
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Al1.14 Mn0.86 O5 Si'
_chemical_name_mineral           Kanonaite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.959
_cell_length_b                   8.047
_cell_length_c                   5.616
_cell_formula_units_Z            4
_cell_volume                     359.683
_database_code_amcsd             0000833
_exptl_crystal_density_diffrn    3.436
_cod_original_formula_sum        '(Mn.86 Al1.14) Si O5'
_cod_database_code               9000816
Beta-Mg2SiO4: Single-crystal X-ray diffraction study case 1
Horiuchi, H.; Sawamoto, H.; American Mineralogist 66 (1981) 568–575; doi:

data_9000817
_publ_section_title
;
 Beta-Mg2SiO4: Single-crystal X-ray diffraction study
 case 1
;
_journal_name_full               'American Mineralogist'
_journal_page_first              568
_journal_page_last               575
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Wadsleyite
_space_group_IT_number           74
_symmetry_space_group_name_Hall  '-I 2b 2'
_symmetry_space_group_name_H-M   'I m m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.6983
_cell_length_b                   11.4380
_cell_length_c                   8.2566
_cell_formula_units_Z            8
_cell_volume                     538.142
_database_code_amcsd             0000834
_exptl_crystal_density_diffrn    3.473
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9000817
Beta-Mg2SiO4: Single-crystal X-ray diffraction study case 2
Horiuchi, H.; Sawamoto, H.; American Mineralogist 66 (1981) 568–575; doi:

data_9000818
_publ_section_title
;
 Beta-Mg2SiO4: Single-crystal X-ray diffraction study
 case 2
;
_journal_name_full               'American Mineralogist'
_journal_page_first              568
_journal_page_last               575
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Wadsleyite
_space_group_IT_number           74
_symmetry_space_group_name_Hall  '-I 2b 2'
_symmetry_space_group_name_H-M   'I m m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.6983
_cell_length_b                   11.4380
_cell_length_c                   8.2566
_cell_formula_units_Z            8
_cell_volume                     538.142
_database_code_amcsd             0000835
_exptl_crystal_density_diffrn    3.473
_cod_original_formula_sum        'Si Mg2 O4'
_cod_database_code               9000818
Crystal structure of a silica- and alkali-rich trioctahedral mica
Hazen, R. M.; Finger, L. W.; Velde, D.; American Mineralogist 66 (1981) 586–591; doi:

data_9000819
_publ_section_title
;
 Crystal structure of a silica- and alkali-rich trioctahedral mica
;
_journal_name_full               'American Mineralogist'
_journal_page_first              586
_journal_page_last               591
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum
'F2 Fe0.688 K Li0.225 Mg2.664 Na0.111 O10 Si3.312'
_chemical_name_mineral           Mica
_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                 100
_cell_angle_gamma                90
_cell_length_a                   5.329
_cell_length_b                   9.230
_cell_length_c                   10.219
_cell_formula_units_Z            2
_cell_volume                     495.002
_database_code_amcsd             0000836
_exptl_crystal_density_diffrn    2.935
_cod_original_formula_sum
'(Si3.312 Fe.688) (Mg2.664 Li.225 Na.111) K O10 F2'
_cod_database_code               9000819
The crystal chemistry of the uranyl silicate minerals Note: signs of y and z are changed for many of the atoms
Stohl, F. V.; Smith, D. K.; American Mineralogist 66 (1981) 610–625; doi:

data_9000820
_publ_section_title
;
 The crystal chemistry of the uranyl silicate minerals
 Note: signs of y and z are changed for many of the atoms
;
_journal_name_full               'American Mineralogist'
_journal_page_first              610
_journal_page_last               625
_journal_volume                  66
_journal_year                    1981
_chemical_compound_source        'Shinkolobwe, Katanga'
_chemical_formula_sum            'Ca H8 O16 Si2 U2'
_chemical_name_mineral           'Uranophane - alpha'
_space_group_IT_number           4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 97.55
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   15.858
_cell_length_b                   6.985
_cell_length_c                   6.641
_cell_volume                     729.234
_database_code_amcsd             0000837
_exptl_crystal_density_diffrn    3.809
_cod_original_formula_sum        'U2 Si2 O16 Ca H8'
_cod_database_code               9000820
The crystal chemistry of the uranyl silicate minerals
Stohl, F. V.; Smith, D. K.; American Mineralogist 66 (1981) 610–625; doi:

data_9000821
_publ_section_title
;
 The crystal chemistry of the uranyl silicate minerals
;
_journal_name_full               'American Mineralogist'
_journal_page_first              610
_journal_page_last               625
_journal_volume                  66
_journal_year                    1981
_chemical_compound_source        'New Method mine, Amboy, California, USA'
_chemical_formula_sum            'H2 K O7 Si U'
_chemical_name_mineral           Boltwoodite
_space_group_IT_number           4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 105.75
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.073
_cell_length_b                   7.064
_cell_length_c                   6.638
_cell_volume                     319.207
_database_code_amcsd             0000838
_exptl_crystal_density_diffrn    4.362
_cod_original_formula_sum        'U K Si O7 H2'
_cod_database_code               9000821
The crystal chemistry of the uranyl silicate minerals
Stohl, F. V.; Smith, D. K.; American Mineralogist 66 (1981) 610–625; doi:

data_9000822
_publ_section_title
;
 The crystal chemistry of the uranyl silicate minerals
;
_journal_name_full               'American Mineralogist'
_journal_page_first              610
_journal_page_last               625
_journal_volume                  66
_journal_year                    1981
_chemical_compound_source        'Anderson mine, Yavapai County, Arizona, USA'
_chemical_formula_sum            'O7 Si U'
_chemical_name_mineral           Weeksite
_space_group_IT_number           38
_symmetry_space_group_name_Hall  'A 2 -2'
_symmetry_space_group_name_H-M   'A m m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.106
_cell_length_b                   17.900
_cell_length_c                   7.087
_cell_formula_units_Z            4
_cell_volume                     901.448
_database_code_amcsd             0000839
_exptl_crystal_density_diffrn    2.786
_cod_original_formula_sum        'U Si O7'
_cod_database_code               9000822
Cation ordering in synthetic and natural Ni-Mg olivine natural
Bish, D. L.; American Mineralogist 66 (1981) 770–776; doi:

data_9000823
_publ_section_title
;
 Cation ordering in synthetic and natural Ni-Mg olivine
 natural
;
_journal_name_full               'American Mineralogist'
_journal_page_first              770
_journal_page_last               776
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Mg0.34 Ni1.66 O4 Si'
_chemical_name_mineral           Liebenbergite
_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_length_a                   4.7311
_cell_length_b                   10.1797
_cell_length_c                   5.9408
_cell_formula_units_Z            4
_cell_volume                     286.116
_database_code_amcsd             0000840
_exptl_crystal_density_diffrn    4.591
_cod_original_formula_sum        'Ni1.66 Mg.34 Si O4'
_cod_database_code               9000823
Cation ordering in synthetic and natural Ni-Mg olivine synthetic
Bish, D. L.; American Mineralogist 66 (1981) 770–776; doi:

data_9000824
_publ_section_title
;
 Cation ordering in synthetic and natural Ni-Mg olivine
 synthetic
;
_journal_name_full               'American Mineralogist'
_journal_page_first              770
_journal_page_last               776
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Mg0.84 Ni1.16 O4 Si'
_chemical_name_mineral           Liebenbergite
_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_length_a                   4.7366
_cell_length_b                   10.164
_cell_length_c                   5.9322
_cell_formula_units_Z            4
_cell_volume                     285.593
_database_code_amcsd             0000841
_exptl_crystal_density_diffrn    4.200
_cod_original_formula_sum        '(Ni1.16 Mg.84) Si O4'
_cod_database_code               9000824
Fillowite, Na2Ca(Mn,Fe)7(PO4)6: Its crystal structure
Araki, T.; Moore, P. B.; American Mineralogist 66 (1981) 827–842; doi:

data_9000825
_publ_section_title
;
 Fillowite, Na2Ca(Mn,Fe)7(PO4)6: Its crystal structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              827
_journal_page_last               842
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Ca4.66 Fe8.02 Mn35.6 Na11.72 O144 P36'
_chemical_name_mineral           Fillowite
_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            3
_cell_length_a                   15.282
_cell_length_b                   15.282
_cell_length_c                   43.507
_cell_volume                     8799.341
_database_code_amcsd             0000842
_exptl_crystal_density_diffrn    3.555
_cod_original_cell_volume        8799.340
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Mn35.6 Ca4.66 Fe8.02 Na11.72 P36 O144'
_cod_database_code               9000825
The crystal structure of jagoite
Mellini, M.; Merlino, S.; American Mineralogist 66 (1981) 852–858; doi:

data_9000826
_publ_section_title
;
 The crystal structure of jagoite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              852
_journal_page_last               858
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'Cl3 Fe4.5 O41 Pb11 Si12.5'
_chemical_name_mineral           Jagoite
_space_group_IT_number           190
_symmetry_space_group_name_Hall  'P -6c -2c'
_symmetry_space_group_name_H-M   'P -6 2 c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   8.528
_cell_length_b                   8.528
_cell_length_c                   33.33
_cell_formula_units_Z            2
_cell_volume                     2099.231
_database_code_amcsd             0000843
_exptl_crystal_density_diffrn    5.765
_cod_original_formula_sum        'Pb11 Fe4.5 Si12.5 O41 Cl3'
_cod_database_code               9000826
The crystal structure of calcium oxalate trihydrate Ca(H2O)3(C2O4)
Deganello, S.; Kampf, A. R.; Moore, P. B.; American Mineralogist 66 (1981) 859–865; doi:

data_9000827
_publ_section_title
;
 The crystal structure of calcium oxalate trihydrate Ca(H2O)3(C2O4)
;
_journal_name_full               'American Mineralogist'
_journal_page_first              859
_journal_page_last               865
_journal_volume                  66
_journal_year                    1981
_chemical_formula_structural     'Ca (H2 O)3 (C2 O4)'
_chemical_formula_sum            'C2 H6 Ca O7'
_chemical_name_mineral           Caoxite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                112.30
_cell_angle_beta                 108.87
_cell_angle_gamma                89.92
_cell_formula_units_Z            2
_cell_length_a                   7.145
_cell_length_b                   8.600
_cell_length_c                   6.099
_cell_volume                     324.935
_database_code_amcsd             0000844
_exptl_crystal_density_diffrn    1.923
_cod_original_formula_sum        'Ca C2 O7 H12'
_cod_database_code               9000827
_amcsd_formula_title             Ca(H2O)3(C2O4)
Tivanite, a new oxyhydroxide mineral from Western Australia, and its structural relationship to rutile and diaspore
Grey, I. E.; Nickel, E. H.; American Mineralogist 66 (1981) 866–871; doi:

data_9000828
_publ_section_title
;Tivanite, a new oxyhydroxide mineral from Western Australia, and its
 structural relationship to rutile and diaspore
;
_journal_name_full               'American Mineralogist'
_journal_page_first              866
_journal_page_last               871
_journal_volume                  66
_journal_year                    1981
_chemical_formula_sum            'O4 Ti V'
_chemical_name_mineral           Tivanite
_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                 129.79
_cell_angle_gamma                90
_cell_length_a                   7.494
_cell_length_b                   4.552
_cell_length_c                   10.005
_cell_formula_units_Z            4
_cell_volume                     262.251
_exptl_crystal_density_diffrn    4.124
_cod_original_formula_sum        'Ti V O4'
_cod_database_code               9000828
The arrojadite-dickinsonite series, KNa4Ca(Fe,Mn)14Al(OH)2(PO4)12: Crystal structure and crystal chemistry sample NM
Moore, P. B.; Araki, T.; Merlino, S.; Mellini, M.; Zanazzi, P. F.; American Mineralogist 66 (1981) 1034–1049; doi:

data_9000829
_publ_section_title
;
 The arrojadite-dickinsonite series, KNa4Ca(Fe,Mn)14Al(OH)2(PO4)12:
 Crystal structure and crystal chemistry
 sample NM
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1034
_journal_page_last               1049
_journal_volume                  66
_journal_year                    1981
_chemical_compound_source
'Nancy mine, North Groton, New Hampshire, USA'
_chemical_formula_sum            'Al Ca F2 Fe14 K Na4 O48 P12'
_chemical_name_mineral           Arrojadite-(KFe)
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-A 2ya'
_symmetry_space_group_name_H-M   'A 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 105.78
_cell_angle_gamma                90
_cell_length_a                   24.692
_cell_length_b                   10.031
_cell_length_c                   16.453
_cell_formula_units_Z            4
_cell_volume                     3921.588
_database_code_amcsd             0000846
_exptl_crystal_density_diffrn    3.654
_cod_original_cell_volume        3921.587
_cod_original_formula_sum        'Al Fe14 Ca Na4 K P12 O48 F2'
_cod_database_code               9000829