LMucko/crystallography-open-database huggingface dataset:
Crystal structure of thallium tetrafluoroborate
Lutz, H.D.; Moeller, H.; Zeitschrift fuer Kristallographie (149,1979-) 201 (1992) 285–286; doi:10.1524/zkri.1992.201.3-4.285

data_8103456
_publ_section_title
;
 Crystal structure of thallium tetrafluoroborate
;
_journal_name_full               'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              285
_journal_page_last               286
_journal_paper_doi               10.1524/zkri.1992.201.3-4.285
_journal_volume                  201
_journal_year                    1992
_chemical_formula_sum            'B F4 Tl'
_chemical_name_systematic        'Tl (B F4)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.207
_cell_length_b                   5.7217
_cell_length_c                   7.3649
_cell_volume                     387.981
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            boron0-1_225.cif
_cod_data_source_block           B1F4Tl1
_cod_original_cell_volume        387.9807
_cod_original_formula_sum        'B1 F4 Tl1'
_cod_database_code               8103456
Structural studies of trifluorosulfur(IV)yl, (S F3)(+), salts including the crystal structure of (S F3)(+) (B F4)(-)
Zalkin, A.; Gibler, D.D.; Fischer, M.; Bartlett, N.; Adams, C.J.; Inorganic Chemistry 11 (1972) 2325–2329; doi:10.1021/ic50116a007

data_4331443
_publ_section_title
;
 Structural studies of trifluorosulfur(IV)yl, (S F3)(+), salts including
 the crystal structure of (S F3)(+) (B F4)(-)
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              2325
_journal_page_last               2329
_journal_paper_doi               10.1021/ic50116a007
_journal_volume                  11
_journal_year                    1972
_chemical_formula_sum            'B F7 S'
_chemical_name_systematic        'S F3 B F4'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.599
_cell_length_b                   5.755
_cell_length_c                   8.974
_cell_volume                     495.744
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            boron0-1_226.cif
_cod_data_source_block           B1F7S1
_cod_original_cell_volume        495.7439
_cod_original_formula_sum        'B1 F7 S1'
_cod_database_code               4331443
Strukturen im System Sn F2 - B F3
Bergerhoff, G.; Boenisch, J.; Zeitschrift fuer Anorganische und Allgemeine Chemie 473 (1981) 35–41; doi:10.1002/zaac.19814730204

data_1511126
_publ_section_title
;
 Strukturen im System Sn F2 - B F3
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              35
_journal_page_last               41
_journal_paper_doi               10.1002/zaac.19814730204
_journal_volume                  473
_journal_year                    1981
_chemical_formula_sum            'B F7 Sn2'
_chemical_name_systematic        'Sn2 F3 B F4'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 111.31
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.395
_cell_length_b                   8.978
_cell_length_c                   14.894
_cell_volume                     672.086
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            boron0-1_227.cif
_cod_data_source_block           B1F7Sn2
_cod_original_formula_sum        'B1 F7 Sn2'
_cod_database_code               1511126
Crystal structure of (N F4)(+) salts
Fawcett, J.; Christe, K.O.; Russell, D.R.; Thorup, N.; David, L.M.; Inorganic Chemistry 27 (1988) 2450–2454; doi:10.1021/ic00287a016

data_4331444
_publ_section_title
;
 Crystal structure of (N F4)(+) salts
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              2450
_journal_page_last               2454
_journal_paper_doi               10.1021/ic00287a016
_journal_volume                  27
_journal_year                    1988
_chemical_formula_sum            'B F8 N'
_chemical_name_systematic        '(N F4) (B F4)'
_space_group_IT_number           113
_symmetry_space_group_name_Hall  'P -4 2ab'
_symmetry_space_group_name_H-M   'P -4 21 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.92
_cell_length_b                   9.92
_cell_length_c                   6.23
_cell_volume                     613.072
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            boron0-1_228.cif
_cod_data_source_block           B1F8N1
_cod_original_cell_volume        613.0719
_cod_original_formula_sum        'B1 F8 N1'
_cod_database_code               4331444
Strukturen im System Sn F2 - B F3
Bergerhoff, G.; Boenisch, J.; Zeitschrift fuer Anorganische und Allgemeine Chemie 473 (1981) 35–41; doi:10.1002/zaac.19814730204

data_1511127
_publ_section_title
;
 Strukturen im System Sn F2 - B F3
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              35
_journal_page_last               41
_journal_paper_doi               10.1002/zaac.19814730204
_journal_volume                  473
_journal_year                    1981
_chemical_formula_sum            'B F9 Sn3'
_chemical_name_systematic        'Sn3 F5 B F4'
_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                 98.29
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.772
_cell_length_b                   7.638
_cell_length_c                   10.328
_cell_volume                     840.873
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            boron0-1_229.cif
_cod_data_source_block           B1F9Sn3
_cod_original_formula_sum        'B1 F9 Sn3'
_cod_database_code               1511127
Structure and magnetic properties of new bcc A2-type based superstructures in R-Fe-B systems
Wang, R.-J.; Khan, Y.; Kneller, E.; Zeitschrift fuer Metallkunde 84 (1993) 881–885; doi:

data_1511128
_publ_section_title
;
 Structure and magnetic properties of new bcc A2-type based
 superstructures in R-Fe-B systems
;
_journal_name_full               'Zeitschrift fuer Metallkunde'
_journal_page_first              881
_journal_page_last               885
_journal_volume                  84
_journal_year                    1993
_chemical_formula_sum            'B0.244 Dy0.098 Fe1.658'
_chemical_name_systematic        '(B5 Dy2 Fe34)0.05'
_space_group_IT_number           229
_symmetry_space_group_name_Hall  '-I 4 2 3'
_symmetry_space_group_name_H-M   'I m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.068
_cell_length_b                   3.068
_cell_length_c                   3.068
_cell_volume                     28.878
_citation_journal_id_ASTM        ZEMTAE
_cod_data_source_file            boron0-1_23.cif
_cod_data_source_block           B0.244Dy0.098Fe1.658
_cod_original_cell_volume        28.87793
_cod_database_code               1511128
Li M B O3 (M = Mn, Fe, Co): synthesis, crystal structure and lithium deinsertion/insertion properties
le Gal la Salle, A.; Guyomard, D.; Verbaere, A.; Piffard, Y.; An, Y.; Portal, R.; Mosbah, A.; Legagneur, V.; Solid State Ionics 139 (2001) 37–46; doi:10.1016/S0167-2738(00)00813-4

data_1511129
_publ_section_title
;
 Li M B O3 (M = Mn, Fe, Co): synthesis, crystal structure and lithium
 deinsertion/insertion properties
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              37
_journal_page_last               46
_journal_paper_doi               10.1016/S0167-2738(00)00813-4
_journal_volume                  139
_journal_year                    2001
_chemical_formula_sum            'B Fe Li O3'
_chemical_name_systematic        'Li Fe (B O3)'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 91.39
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   5.169
_cell_length_b                   8.924
_cell_length_c                   10.138
_cell_volume                     467.510
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            boron0-1_230.cif
_cod_data_source_block           B1Fe1Li1O3
_cod_original_cell_volume        467.5096
_cod_original_formula_sum        'B1 Fe1 Li1 O3'
_cod_database_code               1511129
Zur Synthese und Kristallstruktur von manganhaltigen Boratoxiden: Mn Fe (B O3) O und Mn Al0.5 Y0.5 (B O3) O
Bluhm, K.; Utzolino, A.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 50 (1995) 1146–1150; doi:

data_7209465
_publ_section_title
;
 Zur Synthese und Kristallstruktur von manganhaltigen Boratoxiden: Mn Fe
 (B O3) O und Mn Al0.5 Y0.5 (B O3) O
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische
 Chemie (42,1987-)
;
_journal_page_first              1146
_journal_page_last               1150
_journal_volume                  50
_journal_year                    1995
_chemical_formula_sum            'B Fe Mn O4'
_chemical_name_systematic        'Fe Mn (B O3) O'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.3992
_cell_length_b                   3.1941
_cell_length_c                   9.3911
_cell_volume                     281.939
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            boron0-1_231.cif
_cod_data_source_block           B1Fe1Mn1O4
_cod_original_cell_volume        281.9395
_cod_original_formula_sum        'B1 Fe1 Mn1 O4'
_cod_database_code               7209465
The crystal structure of Nb Fe B and Ta Fe B compounds
Kuz'ma, Yu.B.; Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Tekhnichni ta Matematichni Nauki 1967 (1967) 939–940; doi:

data_1511130
_publ_section_title
;
 The crystal structure of Nb Fe B and Ta Fe B compounds
;
_journal_name_full
;
Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Tekhnichni ta
 Matematichni Nauki
;
_journal_page_first              939
_journal_page_last               940
_journal_volume                  1967
_journal_year                    1967
_chemical_formula_sum            'B Fe Nb'
_chemical_name_systematic        'Nb Fe B'
_space_group_IT_number           189
_symmetry_space_group_name_Hall  'P -6 -2'
_symmetry_space_group_name_H-M   'P -6 2 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   6.015
_cell_length_b                   6.015
_cell_length_c                   3.222
_cell_volume                     100.955
_citation_journal_id_ASTM        DUKABM
_cod_data_source_file            boron0-1_232.cif
_cod_data_source_block           B1Fe1Nb1
_cod_original_cell_volume        100.9549
_cod_original_formula_sum        'B1 Fe1 Nb1'
_cod_database_code               1511130
Crystal structure refinement of ferric borate, Fe B O3
Diehl, R.; Solid State Communications 17 (1975) 743–745; doi:10.1016/0038-1098(75)90399-3

data_1511131
_publ_section_title
;
 Crystal structure refinement of ferric borate, Fe B O3
;
_journal_name_full               'Solid State Communications'
_journal_page_first              743
_journal_page_last               745
_journal_paper_doi               10.1016/0038-1098(75)90399-3
_journal_volume                  17
_journal_year                    1975
_chemical_formula_sum            'B Fe O3'
_chemical_name_systematic        'Fe B O3'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   4.626
_cell_length_b                   4.626
_cell_length_c                   14.493
_cell_volume                     268.596
_citation_journal_id_ASTM        SSCOA4
_cod_data_source_file            boron0-1_233.cif
_cod_data_source_block           B1Fe1O3
_cod_original_cell_volume        268.5964
_cod_original_formula_sum        'B1 Fe1 O3'
_cod_database_code               1511131
Zur Synthese und Kristallstruktur von Zinkboratoxiden mit isolierten, trigonalen planaren BO3-Baugruppen: Zn5Mn(BO3)2O4 und ZnFe(BO3)O
Busche, S.; Bluhm, K.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 50 (1995) 1450–1454; doi:

data_7209466
_publ_section_title
;
 Zur Synthese und Kristallstruktur von Zinkboratoxiden mit isolierten,
 trigonalen planaren BO3-Baugruppen: Zn5Mn(BO3)2O4 und ZnFe(BO3)O
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische
 Chemie (42,1987-)
;
_journal_page_first              1450
_journal_page_last               1454
_journal_volume                  50
_journal_year                    1995
_chemical_formula_sum            'B Fe O4 Zn'
_chemical_name_systematic        'Zn Fe (B O3) O'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.2462
_cell_length_b                   3.141
_cell_length_c                   9.353
_cell_volume                     271.633
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            boron0-1_234.cif
_cod_data_source_block           B1Fe1O4Zn1
_cod_original_cell_volume        271.6328
_cod_original_formula_sum        'B1 Fe1 O4 Zn1'
_cod_database_code               7209466
Neutron-diffraction and Moessbauer-effect studies of Pr2 (Fe1- xMnx)14 B
Pringle, O.A.; Long, G.J.; Yelon, W.B.; Xie, D.; Grandjean, F.; Fu, J.; James, W.J.; Journal of Applied Physics 67 (1990) 4762–4764; doi:10.1063/1.344778

data_1511132
_publ_section_title
;
 Neutron-diffraction and Moessbauer-effect studies of Pr2 (Fe1- xMnx)14 B
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              4762
_journal_page_last               4764
_journal_paper_doi               10.1063/1.344778
_journal_volume                  67
_journal_year                    1990
_chemical_formula_sum            'B Fe12 Mn2 Pr2'
_chemical_name_systematic        'Fe12 Mn2 Pr2 B'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.784
_cell_length_b                   8.784
_cell_length_c                   12.2086
_cell_volume                     941.999
_citation_journal_id_ASTM        JAPIAU
_cod_data_source_file            boron0-1_235.cif
_cod_data_source_block           B1Fe12Mn2Pr2
_cod_original_cell_volume        941.9993
_cod_original_formula_sum        'B1 Fe12 Mn2 Pr2'
_cod_database_code               1511132
Neutron-diffraction and Moessbauer-effect study of the preterential silicon site occupation and magnetic structure of Nd2Fe14-xSixB
Grandjean, F.; Yelon, W.B.; Pringle, O.A.; Marasinghe, G.K.; Long, G.J.; Li, J.; James, W.J.; Xie, D.; Journal of Applied Physics 74 (1993) 6798–6809; doi:10.1063/1.355080

data_1511133
_publ_section_title
;
 Neutron-diffraction and Moessbauer-effect study of the preterential
 silicon site occupation and magnetic structure of Nd2Fe14-xSixB
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              6798
_journal_page_last               6809
_journal_paper_doi               10.1063/1.355080
_journal_volume                  74
_journal_year                    1993
_chemical_formula_sum            'B Fe12 Nd2 Si2'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.7286
_cell_length_b                   8.7286
_cell_length_c                   12.0662
_cell_volume                     919.305
_citation_journal_id_ASTM        JAPIAU
_cod_data_source_file            boron0-1_236.cif
_cod_data_source_block           B1Fe12Nd2Si2
_cod_original_cell_volume        919.3051
_cod_original_formula_sum        'B1 Fe12 Nd2 Si2'
_cod_database_code               1511133
New b.c.c. three-dimensional A2-type Zr2-xFe14-ySiyBz superstructures
Khan, Y.; Physica Status Solidi, Sectio A: Applied Research 130 (1992) 7–12; doi:

data_1511134
_publ_section_title
;
 New b.c.c. three-dimensional A2-type Zr2-xFe14-ySiyBz superstructures
;
_journal_name_full
'Physica Status Solidi, Sectio A: Applied Research'
_journal_page_first              7
_journal_page_last               12
_journal_volume                  130
_journal_year                    1992
_chemical_formula_sum            'B Fe12 Si2 Zr'
_chemical_name_systematic        'Zr Fe12 Si2 B'
_space_group_IT_number           217
_symmetry_space_group_name_Hall  'I -4 2 3'
_symmetry_space_group_name_H-M   'I -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.16
_cell_length_b                   12.16
_cell_length_c                   12.16
_cell_volume                     1798.046
_citation_journal_id_ASTM        PSSABA
_cod_data_source_file            boron0-1_238.cif
_cod_data_source_block           B1Fe12Si2Zr1
_cod_original_formula_sum        'B1 Fe12 Si2 Zr1'
_cod_database_code               1511134
A neutron diffraction and Moessbauer spectral study of the structure and magnetic properties of the Y2 Fe14-x Six B solid solutions
Grandjean, F.; Marasinghe, G.K.; Long, G.J.; Pringle, O.A.; Yelon, W.B.; Journal of Applied Physics 76 (1994) 2960–2968; doi:10.1063/1.357536

data_1511135
_publ_section_title
;
 A neutron diffraction and Moessbauer spectral study of the structure and
 magnetic properties of the Y2 Fe14-x Six B solid solutions
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              2960
_journal_page_last               2968
_journal_paper_doi               10.1063/1.357536
_journal_volume                  76
_journal_year                    1994
_chemical_formula_sum            'B Fe12.13 Si1.87 Y2'
_chemical_name_systematic        'Y2 Fe12.13 Si1.87 B'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.6856
_cell_length_b                   8.6856
_cell_length_c                   11.9205
_cell_volume                     899.278
_citation_journal_id_ASTM        JAPIAU
_cod_data_source_file            boron0-1_239.cif
_cod_data_source_block           B1Fe12.13Si1.87Y2
_cod_original_cell_volume        899.2784
_cod_original_formula_sum        'B1 Fe12.13 Si1.87 Y2'
_cod_database_code               1511135
Structure and magnetic properties of new bcc A2-type based superstructures in R-Fe-B systems
Wang, R.-J.; Kneller, E.; Khan, Y.; Zeitschrift fuer Metallkunde 84 (1993) 881–885; doi:

data_1511136
_publ_section_title
;
 Structure and magnetic properties of new bcc A2-type based
 superstructures in R-Fe-B systems
;
_journal_name_full               'Zeitschrift fuer Metallkunde'
_journal_page_first              881
_journal_page_last               885
_journal_volume                  84
_journal_year                    1993
_chemical_formula_sum            'B0.244 Er0.098 Fe1.658'
_chemical_name_systematic        '(B5 Er2 Fe34)0.05'
_space_group_IT_number           229
_symmetry_space_group_name_Hall  '-I 4 2 3'
_symmetry_space_group_name_H-M   'I m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.088
_cell_length_b                   3.088
_cell_length_c                   3.088
_cell_volume                     29.446
_citation_journal_id_ASTM        ZEMTAE
_cod_data_source_file            boron0-1_24.cif
_cod_data_source_block           B0.244Er0.098Fe1.658
_cod_original_cell_volume        29.44638
_cod_database_code               1511136
A neutron diffraction and Moessbauer spectral study of the structure and magnetic properties of the Y2 Fe14-x Six B solid solutions
Yelon, W.B.; Marasinghe, G.K.; Grandjean, F.; Pringle, O.A.; Long, G.J.; Journal of Applied Physics 76 (1994) 2960–2968; doi:10.1063/1.357536

data_1511137
_publ_section_title
;
 A neutron diffraction and Moessbauer spectral study of the structure and
 magnetic properties of the Y2 Fe14-x Six B solid solutions
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              2960
_journal_page_last               2968
_journal_paper_doi               10.1063/1.357536
_journal_volume                  76
_journal_year                    1994
_chemical_formula_sum            'B Fe13.33 Si0.67 Y2'
_chemical_name_systematic        'Y2 Fe13.33 Si0.67 B'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.7166
_cell_length_b                   8.7166
_cell_length_c                   11.9713
_cell_volume                     909.569
_citation_journal_id_ASTM        JAPIAU
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