LMucko/crystallography-open-database huggingface dataset:
The crystal structure and composition of crednerite, CuMnO2 Note: calculated bond lengths unreconcileable with reported
Kondrashev, I. D.; Soviet Physics Crystallography 3 (1959) 703–706; doi:

data_9011834
_publ_section_title
;
 The crystal structure and composition of crednerite, CuMnO2
 Note: calculated bond lengths unreconcileable with reported
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              703
_journal_page_last               706
_journal_volume                  3
_journal_year                    1959
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Cu Mn O2'
_chemical_name_mineral           Crednerite
_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                 104.6
_cell_angle_gamma                90
_cell_length_a                   5.530
_cell_length_b                   2.884
_cell_length_c                   5.898
_cell_formula_units_Z            2
_cell_volume                     91.027
_database_code_amcsd             0015535
_exptl_crystal_density_diffrn    5.490
_cod_database_code               9011834
The determination of the structure of seidozerite
Simonov, V. I.; Belov, N. V.; Soviet Physics Crystallography 4 (1960) 146–157; doi:

data_9011835
_publ_section_title
;
 The determination of the structure of seidozerite
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              146
_journal_page_last               157
_journal_volume                  4
_journal_year                    1960
_chemical_formula_sum
'Al0.1 Ca0.4 F2 Fe0.19 Mg0.34 Mn0.46 Na3.6 Nb0.04 O16 Si4 Ti1.26 Zr1.44'
_chemical_name_mineral           Seidozerite
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2yc'
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 102.43
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.53
_cell_length_b                   7.10
_cell_length_c                   18.30
_cell_volume                     701.671
_database_code_amcsd             0015540
_exptl_crystal_density_diffrn    3.537
_cod_original_formula_sum
'Zr1.44 Ti1.26 Mn.46 Mg.34 Fe.19 Nb.04 Al.1 Si4 (Na3.6 Ca.4) O16 F2'
_cod_database_code               9011835
The structures of herderite, datolite and gadolinite determined by direct methods
Pavlov, P. V.; Belov, N. V.; Soviet Physics Crystallography 4 (1959) 300–314; doi:

data_9011836
_publ_section_title
;
 The structures of herderite, datolite and gadolinite determined by direct
 methods
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              300
_journal_page_last               314
_journal_volume                  4
_journal_year                    1959
_chemical_compound_source        'origin of crystal not given'
_chemical_formula_sum            'B Ca H O5 Si'
_chemical_name_mineral           Datolite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.62
_cell_length_b                   7.60
_cell_length_c                   4.84
_cell_volume                     353.862
_database_code_amcsd             0015536
_exptl_crystal_density_diffrn    3.003
_cod_original_sg_symbol_H-M      'P 21/a'
_cod_original_formula_sum        'Ca B Si O5 H'
_cod_database_code               9011836
The structures of herderite, datolite and gadolinite determined by direct methods
Pavlov, P. V.; Belov, N. V.; Soviet Physics Crystallography 4 (1959) 300–314; doi:

data_9011837
_publ_section_title
;
 The structures of herderite, datolite and gadolinite determined by direct
 methods
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              300
_journal_page_last               314
_journal_volume                  4
_journal_year                    1959
_chemical_compound_source        'not given, but the crystal was natural'
_chemical_formula_sum            'Be Ca F O4 P'
_chemical_name_mineral           Herderite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.1
_cell_angle_gamma                90
_cell_length_a                   9.80
_cell_length_b                   7.68
_cell_length_c                   4.80
_cell_formula_units_Z            4
_cell_volume                     361.267
_database_code_amcsd             0015537
_exptl_crystal_density_diffrn    2.998
_cod_original_formula_sum        'Ca Be P O4 F'
_cod_database_code               9011837
The structure of natural fergusonite, and a polymorphic modification
Komkov, A. I.; Soviet Physics Crystallography 4 (1959) 796–800; doi:

data_9011838
_publ_section_title
;
 The structure of natural fergusonite, and a polymorphic modification
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              796
_journal_page_last               800
_journal_volume                  4
_journal_year                    1959
_chemical_compound_source        'Ural Mountains, Russia'
_chemical_formula_sum            'Nb O4 Y0.85 Yb0.15'
_chemical_name_mineral           Fergusonite-(Y)
_space_group_IT_number           88
_symmetry_space_group_name_Hall  'I 4bw -1bw'
_symmetry_space_group_name_H-M   'I 41/a :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.16
_cell_length_b                   5.16
_cell_length_c                   10.89
_cell_formula_units_Z            4
_cell_volume                     289.953
_database_code_amcsd             0015538
_exptl_crystal_density_diffrn    5.920
_cod_original_sg_symbol_H-M      'I 41/a'
_cod_original_formula_sum        '(Y.85 Yb.15) Nb O4'
_cod_database_code               9011838
The structure of natural fergusonite, and of a polymorphic modification Sample: annealed at T = 1000 C for t = 15 min
Komkov, A. I.; Soviet Physics Crystallography 4 (1959) 796–800; doi:

data_9011839
_publ_section_title
;
 The structure of natural fergusonite, and of a polymorphic modification
 Sample: annealed at T = 1000 C for t = 15 min
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              796
_journal_page_last               800
_journal_volume                  4
_journal_year                    1959
_chemical_compound_source        'Ural Mountains, Russia'
_chemical_formula_sum            'Nb O4 Y0.85 Yb0.15'
_chemical_name_mineral           Fergusonite-(Y)
_space_group_IT_number           5
_symmetry_space_group_name_Hall  'I 2y'
_symmetry_space_group_name_H-M   'I 1 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 94.50
_cell_angle_gamma                90
_cell_length_a                   5.05
_cell_length_b                   10.89
_cell_length_c                   5.27
_cell_formula_units_Z            4
_cell_volume                     288.928
_database_code_amcsd             0015539
_exptl_crystal_density_diffrn    5.941
_exptl_crystal_thermal_history   'annealed at T = 1000 C for t = 15 min'
_cod_original_formula_sum        '(Y.85 Yb.15) Nb O4'
_cod_database_code               9011839
Derivation of the structure of lovozerite from sections of the three-dimensional Patterson function
Ilyukhin, V. V.; Belov, N. V.; Soviet Physics Crystallography 5 (1960) 186–198; doi:

data_9011840
_publ_section_title
;Derivation of the structure of lovozerite from sections of the
 three-dimensional Patterson function
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              186
_journal_page_last               198
_journal_volume                  5
_journal_year                    1960
_chemical_formula_sum            'H0.5 Na2.5 O18.5 Si6 Zr'
_chemical_name_mineral           Lovozerite
_space_group_IT_number           5
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 92.5
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   10.48
_cell_length_b                   10.2
_cell_length_c                   7.33
_cell_volume                     782.802
_database_code_amcsd             0015541
_exptl_crystal_density_diffrn    2.604
_cod_original_formula_sum        'Zr Si6 O18.5 Na2.5 H.5'
_cod_database_code               9011840
The crystal structure of anapaite
Rumanova, I. M.; Znamenskaya, M. N.; Soviet Physics Crystallography 5 (1961) 650–658; doi:

data_9011841
_publ_section_title
;
 The crystal structure of anapaite
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              650
_journal_page_last               658
_journal_volume                  5
_journal_year                    1961
_chemical_compound_source
'Zhelezny Rog deposit near Anapa, Tamansk peninsula'
_chemical_formula_sum            'Ca2 Fe H8 O12 P2'
_chemical_name_mineral           Anapaite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                101
_cell_angle_beta                 104
_cell_angle_gamma                71
_cell_formula_units_Z            1
_cell_length_a                   6.39
_cell_length_b                   6.86
_cell_length_c                   5.89
_cell_volume                     235.099
_database_code_amcsd             0015542
_exptl_crystal_density_diffrn    2.811
_cod_original_formula_sum        'Ca2 Fe P2 O12 H8'
_cod_database_code               9011841
An electron diffraction study of the structure of PbBi4Te7 Loality: synthetic
Talybov, A. G.; Vainshtein, B. K.; Soviet Physics Crystallography 6 (1962) 432–438; doi:

data_9011842
_publ_section_title
;
 An electron diffraction study of the structure of PbBi4Te7
 Loality: synthetic
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              432
_journal_page_last               438
_journal_volume                  6
_journal_year                    1962
_chemical_formula_sum            'Bi3 Pb0.75 Te5.25'
_chemical_name_mineral           Kochkarite
_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                   4.50
_cell_length_b                   4.50
_cell_length_c                   17.600
_cell_formula_units_Z            1
_cell_volume                     308.651
_database_code_amcsd             0015543
_exptl_crystal_density_diffrn    7.813
_cod_original_formula_sum        'Bi3 Te5.25 Pb.75'
_cod_database_code               9011842
The crystal structure of beryllonite (NaBePO4)
Golovastikov, N. I.; Soviet Physics Crystallography 6 (1962) 733–739; doi:

data_9011843
_publ_section_title
;
 The crystal structure of beryllonite (NaBePO4)
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              733
_journal_page_last               739
_journal_volume                  6
_journal_year                    1962
_chemical_compound_source        'Stoneham, Maine, USA'
_chemical_formula_sum            'Be Na O4 P'
_chemical_name_mineral           Beryllonite
_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                 90.0
_cell_angle_gamma                90
_cell_length_a                   8.16
_cell_length_b                   7.79
_cell_length_c                   14.08
_cell_formula_units_Z            12
_cell_volume                     895.015
_database_code_amcsd             0015544
_exptl_crystal_density_diffrn    2.827
_cod_depositor_comments
;
 Fixing _atom_site_label values from 'Ol0' to 'O10'.

 Antanas Vaitkus
 2013-04-02
;
_cod_original_formula_sum        'Na Be P O4'
_cod_database_code               9011843
An electron diffraction study of the second superlattice in PbBi4Te7
Talybov, A. G.; Vainshtein, B. K.; Soviet Physics Crystallography 7 (1962) 32–37; doi:

data_9011844
_publ_section_title
;
 An electron diffraction study of the second superlattice in PbBi4Te7
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              32
_journal_page_last               37
_journal_volume                  7
_journal_year                    1962
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Bi3 Pb0.75 Te5.25'
_chemical_name_mineral           Kochkarite
_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                   4.44
_cell_length_b                   4.44
_cell_length_c                   71.7
_cell_formula_units_Z            4
_cell_volume                     1224.097
_database_code_amcsd             0015545
_exptl_crystal_density_diffrn    7.880
_cod_original_formula_sum        'Te5.25 Pb.75 Bi3'
_cod_database_code               9011844
Crystal structure of the Ca,Na,Zr,Ti silicate rosenbuschite, Ca3.5Na2.5Zr(Ti,Mn,Nb)[Si2O7]2F2O(F,O) Locality: Kol'skii Peninsula, Russia
Shibaeva, R. P.; Simonov, V. I.; Belov, N. V.; Soviet Physics Crystallography 8 (1963) 406–413; doi:

data_9011845
_publ_section_title
;Crystal structure of the Ca,Na,Zr,Ti silicate rosenbuschite,
 Ca3.5Na2.5Zr(Ti,Mn,Nb)[Si2O7]2F2O(F,O) Locality: Kol'skii Peninsula, Russia
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              406
_journal_page_last               413
_journal_volume                  8
_journal_year                    1963
_chemical_compound_source        'Kol'skii Peninsula, Russia'
_chemical_formula_sum            'Ca7 F4 Mn Na5 O32 Si8 Ti Zr2'
_chemical_name_mineral           Rosenbuschite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                91.33
_cell_angle_beta                 99.67
_cell_angle_gamma                111.83
_cell_length_a                   10.12
_cell_length_b                   11.39
_cell_length_c                   7.27
_cell_formula_units_Z            1
_cell_volume                     763.478
_database_code_amcsd             0015546
_exptl_crystal_density_diffrn    3.248
_cod_original_formula_sum        'Zr2 (Ti Mn) Ca7 Na5 Si8 O32 F4'
_cod_database_code               9011845
Study of the copper-tellurium system in thin films
Baranova, R. V.; Pinsker, Z. G.; Soviet Physics Crystallography 9 (1964) 83–85; doi:

data_9011846
_publ_section_title
;
 Study of the copper-tellurium system in thin films
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              83
_journal_page_last               85
_journal_volume                  9
_journal_year                    1964
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Cu Te'
_chemical_name_mineral           Vulcanite
_space_group_IT_number           59
_symmetry_space_group_name_Hall  'P 2 2ab -1ab'
_symmetry_space_group_name_H-M   'P m m n :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.10
_cell_length_b                   4.02
_cell_length_c                   6.86
_cell_formula_units_Z            2
_cell_volume                     85.489
_database_code_amcsd             0015547
_exptl_crystal_density_diffrn    7.426
_cod_original_sg_symbol_H-M      'P m m n'
_cod_database_code               9011846
The structure of sklodowskite
Mokeeva, V. I.; Soviet Physics Crystallography 9 (1964) 217–218; doi:

data_9011847
_publ_section_title
;
 The structure of sklodowskite
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              217
_journal_page_last               218
_journal_volume                  9
_journal_year                    1964
_chemical_formula_sum            'H12 Mg O18 Si2 U2'
_chemical_name_mineral           Sklodowskite
_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                 96.33
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   16.89
_cell_length_b                   7.01
_cell_length_c                   6.60
_cell_volume                     776.669
_database_code_amcsd             0015548
_exptl_crystal_density_diffrn    3.663
_cod_original_formula_sum        'Mg U2 Si2 O18 H12'
_cod_database_code               9011847
The crystal structure of kasolite
Mokeeva, V. I.; Soviet Physics Crystallography 9 (1965) 621–622; doi:10.1070/PU1967v009n04ABEH003016

data_9011848
_publ_section_title
;
 The crystal structure of kasolite
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              621
_journal_page_last               622
_journal_paper_doi               10.1070/PU1967v009n04ABEH003016
_journal_volume                  9
_journal_year                    1965
_chemical_formula_sum            'O6 Pb Si U'
_chemical_name_mineral           Kasolite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 75.75
_cell_angle_gamma                90
_cell_length_a                   13.28
_cell_length_b                   6.96
_cell_length_c                   6.74
_cell_formula_units_Z            4
_cell_volume                     603.802
_database_code_amcsd             0015549
_exptl_crystal_density_diffrn    6.263
_cod_original_formula_sum        'Pb U Si O6'
_cod_database_code               9011848
The structure of calcium seidozerite
Skszat, S. M.; Simonov, V. I.; Soviet Physics Crystallography 10 (1966) 505–508; doi:

data_9011849
_publ_section_title
;
 The structure of calcium seidozerite
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              505
_journal_page_last               508
_journal_volume                  10
_journal_year                    1966
_chemical_compound_source        'Baikal area, Russia'
_chemical_formula_sum
'Ca1.28 F2 Fe0.42 Mn0.56 Na3.56 O16 Si4 Ti0.78 Zr1.4'
_chemical_name_mineral           Seidozerite
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2yc'
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 102.40
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.54
_cell_length_b                   7.10
_cell_length_c                   18.36
_cell_volume                     705.326
_database_code_amcsd             0015550
_exptl_crystal_density_diffrn    3.573
_cod_original_formula_sum
'Zr1.4 Mn.56 Fe.42 Ti.78 Ca1.28 Na3.56 Si4 O16 F2'
_cod_database_code               9011849
Determination of the crystal structure of the hexagonal phase in the silver-tellurium system
Imamov, R. M.; Pinsker, Z. G.; Soviet Physics Crystallography 11 (1966) 182–188; doi:

data_9011850
_publ_section_title
;
 Determination of the crystal structure of the hexagonal phase in the
 silver-tellurium system
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              182
_journal_page_last               188
_journal_volume                  11
_journal_year                    1966
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Ag35 Te20'
_chemical_name_mineral           Stutzite
_space_group_IT_number           191
_symmetry_space_group_name_Hall  '-P 6 2'
_symmetry_space_group_name_H-M   'P 6/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   13.48
_cell_length_b                   13.48
_cell_length_c                   8.49
_cell_formula_units_Z            1
_cell_volume                     1336.036
_database_code_amcsd             0015551
_exptl_crystal_density_diffrn    7.864
_cod_database_code               9011850
Determination of the structure of Tl2S by the electron diffraction method
Man, L. I.; Soviet Physics Crystallography 15 (1970) 399–403; doi:

data_9011851
_publ_section_title
;
 Determination of the structure of Tl2S by the electron diffraction method
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              399
_journal_page_last               403
_journal_volume                  15
_journal_year                    1970
_chemical_compound_source        Synthetic
_chemical_formula_sum            'S Tl2'
_chemical_name_mineral           Carlinite
_space_group_IT_number           146
_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_length_a                   12.20
_cell_length_b                   12.20
_cell_length_c                   18.17
_cell_formula_units_Z            27
_cell_volume                     2342.099
_database_code_amcsd             0015553
_exptl_crystal_density_diffrn    8.439
_cod_original_sg_symbol_H-M      'R 3'
_cod_original_formula_sum        'Tl2 S'
_cod_database_code               9011851
Crystal structure of innelite - Na2Ba3(Ba,K,Mn)(Ca,Na)Ti(TiO2)2[Si2O7]2(SO4)2
Chernov, A. N.; Ilyukhin, V. V.; Maksimov, B. A.; Belov, N. V.; Soviet Physics Crystallography 16 (1971) 65–69; doi:

data_9011852
_publ_section_title
;Crystal structure of innelite - Na2Ba3(Ba,K,Mn)(Ca,Na)Ti(TiO2)2[Si2O7]2(SO4)2
;
_journal_name_full               'Soviet Physics Crystallography'
_journal_page_first              65
_journal_page_last               69
_journal_volume                  16
_journal_year                    1971
_chemical_compound_source        'Inaglinskii Massif, Southern Yakusk, Russia'
_chemical_formula_sum
'Ba4 Ca0.16 Fe0.2 Mg0.27 Na2.33 O26 S2 Si4 Ti3'
_chemical_name_mineral           Innelite
_space_group_IT_number           1
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                90
_cell_angle_beta                 95
_cell_angle_gamma                99
_cell_length_a                   14.76
_cell_length_b                   7.14
_cell_length_c                   5.38
_cell_formula_units_Z            1
_cell_volume                     557.814
_database_code_amcsd             0015554
_exptl_crystal_density_diffrn    4.058
_cod_original_formula_sum        'Na2.33 Ca.16 Mg.27 Fe.2 Ba4 Ti3 Si4 S2 O26'
_cod_database_code               9011852