LMucko/crystallography-open-database huggingface dataset:
Synthesis, characterization, and crystal structure of Na3 B20, determined and refined from x-ray and neutron powder data
Hofmann, K.; Albert, B.; Zeitschrift fuer Anorganische und Allgemeine Chemie 625 (1999) 709–713; doi:

data_1510861
_publ_section_title
;
 Synthesis, characterization, and crystal structure of Na3 B20, determined
 and refined from x-ray and neutron powder data
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              709
_journal_page_last               713
_journal_volume                  625
_journal_year                    1999
_chemical_formula_sum            'B20 Na3'
_chemical_name_systematic        'Na3 B20'
_space_group_IT_number           65
_symmetry_space_group_name_Hall  '-C 2 2'
_symmetry_space_group_name_H-M   'C m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   18.69449
_cell_length_b                   5.7009
_cell_length_c                   4.1506
_cell_volume                     442.352
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            boron_373.cif
_cod_data_source_block           B20Na3
_cod_original_cell_volume        442.3519
_cod_database_code               1510861
Presence of carbon in aluminum borides
Giese, R.F.jr.; Matkovich, V.I.; Economy, J.; Journal of the American Chemical Society 86 (1964) 2337–2340; doi:10.1021/ja01066a007

data_4119070
_publ_section_title
;
 Presence of carbon in aluminum borides
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2337
_journal_page_last               2340
_journal_paper_doi               10.1021/ja01066a007
_journal_volume                  86
_journal_year                    1964
_chemical_formula_sum            'C4 B24'
_chemical_name_systematic        'Al B24 C4'
_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            2
_cell_length_a                   5.69
_cell_length_b                   8.881
_cell_length_c                   9.1
_cell_volume                     459.849
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            boron_374.cif
_cod_data_source_block           B24C4
_cod_original_cell_volume        459.8493
_cod_original_formula_sum        'B24 C4'
_cod_database_code               4119070
U5 Mo10 B24, a boride containing three different kinds of boron polyanions
Konrad, T.; Jeitschko, W.; Journal of Alloys Compd. 233 (1996) 3–7; doi:

data_1510862
_publ_section_title
;
 U5 Mo10 B24, a boride containing three different kinds of boron
 polyanions
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              3
_journal_page_last               7
_journal_volume                  233
_journal_year                    1996
_chemical_formula_sum            'B24 Mo10 U5'
_chemical_name_systematic        'U5 Mo10 B24'
_space_group_IT_number           59
_symmetry_space_group_name_Hall  '-P 2ab 2a'
_symmetry_space_group_name_H-M   'P m m n :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.118
_cell_length_b                   17.897
_cell_length_c                   14.585
_cell_volume                     813.885
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            boron_375.cif
_cod_data_source_block           B24Mo10U5
_cod_original_cell_volume        813.8845
_cod_database_code               1510862
New incommensurate structures of the borides Pr41(Mn4B4)35 and Pr7(Re4B4)6
Zavalii, P.Yu.; Kuz'ma, Yu.B.; Mykhalenko, S.I.; Journal of Alloys Compd. 203 (1994) 55–59; doi:10.1016/0925-8388(94)90714-5

data_1510863
_publ_section_title
;
 New incommensurate structures of the borides Pr41(Mn4B4)35 and
 Pr7(Re4B4)6
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              55
_journal_page_last               59
_journal_paper_doi               10.1016/0925-8388(94)90714-5
_journal_volume                  203
_journal_year                    1994
_chemical_formula_sum            'B24 Pr7 Re24'
_chemical_name_systematic        'Pr7 Re24 B24'
_space_group_IT_number           116
_symmetry_space_group_name_Hall  'P -4 -2c'
_symmetry_space_group_name_H-M   'P -4 c 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.566
_cell_length_b                   10.566
_cell_length_c                   25.22
_cell_volume                     2815.570
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            boron_376.cif
_cod_data_source_block           B24Pr7Re24
_cod_original_cell_volume        2815.57
_cod_database_code               1510863
Crystal structure of the zinc boride (Zn B25) phase.
Kuz'ma, Yu.B.; Gurin, V.N.; Korsukova, M.M.; Aksel'rud, L.G.; Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 23 (1987) 566–569; doi:

data_1510864
_publ_section_title
;
 Crystal structure of the zinc boride (Zn B25) phase.
;
_journal_name_full
'Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy'
_journal_page_first              566
_journal_page_last               569
_journal_volume                  23
_journal_year                    1987
_chemical_formula_sum            'B25.65 Zn'
_chemical_name_systematic        'Zn B25.65'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            12
_cell_length_a                   10.986
_cell_length_b                   10.986
_cell_length_c                   24.016
_cell_volume                     2510.213
_citation_journal_id_ASTM        IVNMAW
_cod_data_source_file            boron_377.cif
_cod_data_source_block           B25.65Zn1
_cod_original_formula_sum        'B25.65 Zn1'
_cod_database_code               1510864
The solubilities of copper and manganese in beta-rhombohedral boron as determined in Cu B28 and Mn B23 by single crystal diffractometry
Callmer, B.; Andersson, S.; Journal of Solid State Chemistry 10 (1974) 219–321; doi:10.1016/0022-4596(74)90029-2

data_1510865
_publ_section_title
;
 The solubilities of copper and manganese in beta-rhombohedral boron as
 determined in Cu B28 and Mn B23 by single crystal diffractometry
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              219
_journal_page_last               321
_journal_paper_doi               10.1016/0022-4596(74)90029-2
_journal_volume                  10
_journal_year                    1974
_chemical_formula_sum            'B25.7244 Mn1.105'
_chemical_name_systematic        '(Mn B23.28)1.105'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            12
_cell_length_a                   10.9875
_cell_length_b                   10.9875
_cell_length_c                   23.9937
_cell_volume                     2508.567
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            boron_378.cif
_cod_data_source_block           B25.7244Mn1.105
_cod_database_code               1510865
A single-crystal diffractometry investigation of scandium in beta-rhomboedral boron
Callmer, B.; Journal of Solid State Chemistry 23 (1978) 391–398; doi:10.1016/0022-4596(78)90089-0

data_1510866
_publ_section_title
;
 A single-crystal diffractometry investigation of scandium in
 beta-rhomboedral boron
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              391
_journal_page_last               398
_journal_paper_doi               10.1016/0022-4596(78)90089-0
_journal_volume                  23
_journal_year                    1978
_chemical_formula_sum            'B27.76 Sc'
_chemical_name_systematic        'Sc B27.76'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            11
_cell_length_a                   10.9658
_cell_length_b                   10.9658
_cell_length_c                   24.0875
_cell_volume                     2508.436
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            boron_379.cif
_cod_data_source_block           B27.76Sc1
_cod_original_formula_sum        'B27.76 Sc1'
_cod_database_code               1510866
Darstellung und Kristallstruktur von Ca Rh2 B2 und Ca Ir2 B2
Schmidt, B.; Jung, W.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986) 33 (1978) 1430–1433; doi:

data_7209444
_publ_section_title
;
 Darstellung und Kristallstruktur von Ca Rh2 B2 und Ca Ir2 B2
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische
 Chemie (33,1978-41,1986)
;
_journal_page_first              1430
_journal_page_last               1433
_journal_volume                  33
_journal_year                    1978
_chemical_formula_sum            'B2 Ca Rh2'
_chemical_name_systematic        'Ca Rh2 B2'
_space_group_IT_number           70
_symmetry_space_group_name_Hall  'F 2 2 -1d'
_symmetry_space_group_name_H-M   'F d d d :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   10.606
_cell_length_b                   9.24
_cell_length_c                   5.832
_cell_volume                     571.533
_citation_journal_id_ASTM        ZNBAD2
_cod_data_source_file            boron_38.cif
_cod_data_source_block           B2Ca1Rh2
_cod_original_cell_volume        571.5327
_cod_original_sg_symbol_Hall     '-F 2uv 2vw (x+1/8,y+1/8,z+1/8)'
_cod_original_formula_sum        'B2 Ca1 Rh2'
_cod_database_code               7209444
Refinement of the crystal structure of R(1+e) Fe4 B4 compounds (R= Nd, Gd)
Givord, D.; Tenaud, P.; Journal of the Less-Common Metals 123 (1986) 109–116; doi:10.1016/0022-5088(86)90121-9

data_1510867
_publ_section_title
;
 Refinement of the crystal structure of R(1+e) Fe4 B4 compounds (R= Nd,
 Gd)
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              109
_journal_page_last               116
_journal_paper_doi               10.1016/0022-5088(86)90121-9
_journal_volume                  123
_journal_year                    1986
_chemical_formula_sum            'B28 Fe28 Gd8'
_chemical_name_systematic        'Gd8 Fe28 B28'
_space_group_IT_number           56
_symmetry_space_group_name_Hall  '-P 2ab 2ac'
_symmetry_space_group_name_H-M   'P c c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.051
_cell_length_b                   7.051
_cell_length_c                   27.32999
_cell_volume                     1358.754
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            boron_380.cif
_cod_data_source_block           B28Fe28Gd8
_cod_database_code               1510867
Synthesis and magnetic properties of binary boride RE B25 compounds
Zhang, F.; Tanaka, T.; Mori, T.; Journal of Physics: Condensed Matter 13 (2001) 423–430; doi:

data_1510868
_publ_section_title
;
 Synthesis and magnetic properties of binary boride RE B25 compounds
;
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              423
_journal_page_last               430
_journal_volume                  13
_journal_year                    2001
_chemical_formula_sum            'B28 Tb1.069'
_chemical_name_systematic        'Tb1.069 B28'
_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                 89.512
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.855
_cell_length_b                   10.3354
_cell_length_c                   8.2808
_cell_volume                     501.084
_citation_journal_id_ASTM        JCOMEL
_cod_data_source_file            boron_381.cif
_cod_data_source_block           B28Tb1.069
_cod_original_cell_volume        501.0842
_cod_original_sg_symbol_Hall     '-C 2y (x,y,-x+z)'
_cod_database_code               1510868
"Na B15": a new structural description based on X-ray and neutron diffraction, electron microscopy, and solid-state NMR spectroscopy
Eckert, H.; Fild, C.; Gruehn, R.; Albert, B.; Hofmann, K.; Schleifer, M.; Chemistry - A European Journal 6 (2000) 2531–2536; doi:10.1002/1521-3765(20000717)6:14<2531::AID-CHEM2531>3.0.CO;2-2

data_1510869
_publ_section_title
;
 "Na B15": a new structural description based on X-ray and neutron
 diffraction, electron microscopy, and solid-state NMR spectroscopy
;
_journal_name_full               'Chemistry - A European Journal'
_journal_page_first              2531
_journal_page_last               2536
_journal_paper_doi
10.1002/1521-3765(20000717)6:14<2531::AID-CHEM2531>3.0.CO;2-2
_journal_volume                  6
_journal_year                    2000
_chemical_formula_sum            'B29 Na2'
_chemical_name_systematic        'Na2 B29'
_space_group_IT_number           8
_symmetry_space_group_name_Hall  'I -2y'
_symmetry_space_group_name_H-M   'I 1 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.17
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.874
_cell_length_b                   10.403
_cell_length_c                   8.359
_cell_volume                     510.793
_citation_journal_id_ASTM        CEUJED
_cod_data_source_file            boron_382.cif
_cod_data_source_block           B29Na2
_cod_original_sg_symbol_Hall     'C -2y (x,y,-x+z)'
_cod_database_code               1510869
Li Ba B S3 und Li Ba B3 S6: zwei neue quaternaere thioborate mit trigonal-planar koordiniertem Bor
Krebs, B.; Hiltmann, F.; Zeitschrift fuer Anorganische und Allgemeine Chemie 621 (1995) 424–430; doi:10.1002/zaac.19956210315

data_1510870
_publ_section_title
;
 Li Ba B S3 und Li Ba B3 S6: zwei neue quaternaere thioborate mit
 trigonal-planar koordiniertem Bor
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              424
_journal_page_last               430
_journal_paper_doi               10.1002/zaac.19956210315
_journal_volume                  621
_journal_year                    1995
_chemical_formula_sum            'B3 Ba Li S6'
_chemical_name_systematic        'Li Ba B3 S6'
_space_group_IT_number           9
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 117.46
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.116
_cell_length_b                   8.824
_cell_length_c                   8.179
_cell_volume                     968.031
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            boron_383.cif
_cod_data_source_block           B3Ba1Li1S6
_cod_original_cell_volume        968.0309
_cod_original_formula_sum        'B3 Ba1 Li1 S6'
_cod_database_code               1510870
Crystal structures of double borates Ln Ba3 (B O3)3 (Ln= Dy, Ho, Tm, Yb, Lu)
Ilyukhin, A.B.; Dzhurinskii, B.F.; Zhurnal Neorganicheskoi Khimii 38 (1993) 1625–1630; doi:

data_1510871
_publ_section_title
;
 Crystal structures of double borates Ln Ba3 (B O3)3 (Ln= Dy, Ho, Tm, Yb,
 Lu)
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              1625
_journal_page_last               1630
_journal_volume                  38
_journal_year                    1993
_chemical_formula_sum            'B3 Ba3 Dy O9'
_chemical_name_systematic        'Dy Ba3 (B O3)3'
_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            6
_cell_length_a                   13.041
_cell_length_b                   13.041
_cell_length_c                   9.523
_cell_volume                     1402.575
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            boron_384.cif
_cod_data_source_block           B3Ba3Dy1O9
_cod_original_formula_sum        'B3 Ba3 Dy1 O9'
_cod_database_code               1510871
Crystal structures of double borates Ln Ba3 (B O3)3 (Ln= Dy, Ho,T m, Yb, Lu)
Ilyukhin, A.B.; Dzhurinskii, B.F.; Zhurnal Neorganicheskoi Khimii 38 (1993) 1625–1630; doi:

data_1510872
_publ_section_title
;
 Crystal structures of double borates Ln Ba3 (B O3)3 (Ln= Dy, Ho,T m, Yb,
 Lu)
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              1625
_journal_page_last               1630
_journal_volume                  38
_journal_year                    1993
_chemical_formula_sum            'B3 Ba3 Ho O9'
_chemical_name_systematic        'Ho Ba3 (B O3)3'
_space_group_IT_number           185
_symmetry_space_group_name_Hall  'P 6c -2'
_symmetry_space_group_name_H-M   'P 63 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   9.425
_cell_length_b                   9.425
_cell_length_c                   17.599
_cell_volume                     1353.884
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            boron_385.cif
_cod_data_source_block           B3Ba3Ho1O9
_cod_original_formula_sum        'B3 Ba3 Ho1 O9'
_cod_database_code               1510872
Crystal structures of double borates LnBa3(BO3)3(Ln=Dy,Ho,Tm,Yb,Lu)
Ilyukhin, A.B.; Dzhurinskii, B.F.; Zhurnal Neorganicheskoi Khimii 38 (1993) 1625–1630; doi:

data_1510873
_publ_section_title
;
 Crystal structures of double borates LnBa3(BO3)3(Ln=Dy,Ho,Tm,Yb,Lu)
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              1625
_journal_page_last               1630
_journal_volume                  38
_journal_year                    1993
_chemical_formula_sum            'B3 Ba3 Lu O9'
_chemical_name_systematic        'Lu Ba3 (B O3)3'
_space_group_IT_number           185
_symmetry_space_group_name_Hall  'P 6c -2'
_symmetry_space_group_name_H-M   'P 63 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   9.382
_cell_length_b                   9.382
_cell_length_c                   17.421
_cell_volume                     1327.989
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            boron_386.cif
_cod_data_source_block           B3Ba3Lu1O9
_cod_original_formula_sum        'B3 Ba3 Lu1 O9'
_cod_database_code               1510873
The layered borates Ba3 M (B O3)3 (M=Dy,Ho,Y,Er,Tm,Yb,Lu and Sc)
Cox, J.R.; Huang, J.-F.; Keszler, D.A.; Chemistry of Materials (1,1989-) 6 (1994) 2008–2013; doi:

data_4001737
_publ_section_title
;
 The layered borates Ba3 M (B O3)3 (M=Dy,Ho,Y,Er,Tm,Yb,Lu and Sc)
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              2008
_journal_page_last               2013
_journal_volume                  6
_journal_year                    1994
_chemical_formula_sum            'B3 Ba3 O9 Sc'
_chemical_name_systematic        'Ba3 Sc (B O3)3'
_space_group_IT_number           185
_symmetry_space_group_name_Hall  'P 6c -2'
_symmetry_space_group_name_H-M   'P 63 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   9.227
_cell_length_b                   9.227
_cell_length_c                   17.135
_cell_volume                     1263.385
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            boron_387.cif
_cod_data_source_block           B3Ba3O9Sc1
_cod_original_formula_sum        'B3 Ba3 O9 Sc1'
_cod_database_code               4001737
Crystal structures of double borates LnBa3(BO3)3(Ln=Dy,Ho,Tm,Yb,Lu)
Ilyukhin, A.B.; Dzhurinskii, B.F.; Zhurnal Neorganicheskoi Khimii 38 (1993) 1625–1630; doi:

data_1510874
_publ_section_title
;
 Crystal structures of double borates LnBa3(BO3)3(Ln=Dy,Ho,Tm,Yb,Lu)
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              1625
_journal_page_last               1630
_journal_volume                  38
_journal_year                    1993
_chemical_formula_sum            'B3 Ba3 O9 Tm'
_chemical_name_systematic        'Tm Ba3 (B O3)3'
_space_group_IT_number           185
_symmetry_space_group_name_Hall  'P 6c -2'
_symmetry_space_group_name_H-M   'P 63 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   9.395
_cell_length_b                   9.395
_cell_length_c                   17.476
_cell_volume                     1335.876
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            boron_388.cif
_cod_data_source_block           B3Ba3O9Tm1
_cod_original_formula_sum        'B3 Ba3 O9 Tm1'
_cod_database_code               1510874
Structure of low temperature phase beta-(Ba3 Y (B O3)3) crystal
Wang Guofu; Pan Shangke; Jiegon Huaxue 22 (2003) 187–189; doi:

data_1510875
_publ_section_title
;
 Structure of low temperature phase beta-(Ba3 Y (B O3)3) crystal
;
_journal_name_full               'Jiegon Huaxue'
_journal_page_first              187
_journal_page_last               189
_journal_volume                  22
_journal_year                    2003
_chemical_formula_sum            'B3 Ba3 O9 Y'
_chemical_name_systematic        'Ba3 Y (B O3)3'
_space_group_IT_number           185
_symmetry_space_group_name_Hall  'P 6c -2'
_symmetry_space_group_name_H-M   'P 63 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   9.416
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