LMucko/crystallography-open-database huggingface dataset:
An X-ray study of the phases in the copper-titanium system
Karlsson, N.; Journal of the Institute of Metals 79 (1951) 391–405; doi:

data_1538644
_publ_section_title
;
 An X-ray study of the phases in the copper-titanium system
;
_journal_name_full               'Journal of the Institute of Metals'
_journal_page_first              391
_journal_page_last               405
_journal_volume                  79
_journal_year                    1951
_chemical_formula_sum            'Ni3 Ta'
_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_formula_units_Z            2
_cell_length_a                   5.114
_cell_length_b                   4.25
_cell_length_c                   4.542
_cell_volume                     98.718
_citation_journal_id_ASTM        JIMEAP
_cod_data_source_file            Karlsson_JIMEAP_1951_1092.cif
_cod_data_source_block           Ni3Ta1
_cod_original_cell_volume        98.71809
_cod_original_sg_symbol_Hall     '-P 2ab 2a (x-1/4,y-1/4,z)'
_cod_original_formula_sum        'Ni3 Ta1'
_cod_database_code               1538644
Sn Sb polymorphic transformation under high pressure
Losev, V.G.; Kabalkina, S.S.; Vereshchagin, L.F.; Soviet Physics - Solid State (New York) 12 (1970) 2374–2376; doi:

data_1538645
_publ_section_title
;
 Sn Sb polymorphic transformation under high pressure
;
_journal_name_full               'Soviet Physics - Solid State (New York)'
_journal_page_first              2374
_journal_page_last               2376
_journal_volume                  12
_journal_year                    1970
_chemical_formula_sum            'Sb Sn'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.502
_cell_length_b                   3.502
_cell_length_c                   3.502
_cell_volume                     42.949
_citation_journal_id_ASTM        SPSSA7
_cod_data_source_file            Losev_SPSSA7_1970_1852.cif
_cod_data_source_block           Sb1Sn1
_cod_original_cell_volume        42.94854
_cod_original_formula_sum        'Sb1 Sn1'
_cod_database_code               1538645
X-ray investigation of the Hf-Si system from 37 to 65 at.% Si
Karpinskii, O.G.; Evseev, B.A.; Russian Metallurgy 1969 (1969) 128–130; doi:

data_1538646
_publ_section_title
;
 X-ray investigation of the Hf-Si system from 37 to 65 at.% Si
;
_journal_name_full               'Russian Metallurgy'
_journal_page_first              128
_journal_page_last               130
_journal_volume                  1969
_journal_year                    1969
_chemical_formula_sum            'Hf Si2'
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   3.672
_cell_length_b                   14.57
_cell_length_c                   3.641
_cell_volume                     194.797
_citation_journal_id_ASTM        RMLYAQ
_cod_data_source_file            Karpinskii_RMLYAQ_1969_119.cif
_cod_data_source_block           Hf1Si2
_cod_original_cell_volume        194.7973
_cod_original_formula_sum        'Hf1 Si2'
_cod_database_code               1538646
Solid solutions between ferromagnetic and antiferromagnetic compounds with Ni As structure
Lotgering, F.K.; Gorter, E.W.; Journal of Physics and Chemistry of Solids 3 (1957) 238–249; doi:

data_1538647
_publ_section_title
;
 Solid solutions between ferromagnetic and antiferromagnetic compounds
 with Ni As structure
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              238
_journal_page_last               249
_journal_volume                  3
_journal_year                    1957
_chemical_formula_sum            'Mn Sb'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   4.15
_cell_length_b                   4.15
_cell_length_c                   5.78
_cell_volume                     86.209
_citation_journal_id_ASTM        JPCSAW
_cod_data_source_file            Lotgering_JPCSAW_1957_645.cif
_cod_data_source_block           Mn1Sb1
_cod_original_cell_volume        86.20941
_cod_original_formula_sum        'Mn1 Sb1'
_cod_database_code               1538647
X-ray investigation of the Hf-Si system from 37 to 65 at.% Si
Karpinskii, O.G.; Evseev, B.A.; Russian Metallurgy 1969 (1969) 128–130; doi:

data_1538648
_publ_section_title
;
 X-ray investigation of the Hf-Si system from 37 to 65 at.% Si
;
_journal_name_full               'Russian Metallurgy'
_journal_page_first              128
_journal_page_last               130
_journal_volume                  1969
_journal_year                    1969
_chemical_formula_sum            'Hf Si'
_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                   6.889
_cell_length_b                   3.772
_cell_length_c                   5.223
_cell_volume                     135.721
_citation_journal_id_ASTM        RMLYAQ
_cod_data_source_file            Karpinskii_RMLYAQ_1969_120.cif
_cod_data_source_block           Hf1Si1
_cod_original_cell_volume        135.7213
_cod_original_formula_sum        'Hf1 Si1'
_cod_database_code               1538648
Ditellurium(IV) trioxide sulphate
Loub, J.; Podlahova, J.; Novak, C.; Acta Crystallographica B (24,1968-38,1982) 32 (1976) 3115–3116; doi:

data_2107165
_publ_section_title
;
 Ditellurium(IV) trioxide sulphate
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              3115
_journal_page_last               3116
_journal_volume                  32
_journal_year                    1976
_chemical_formula_sum            'O7 S Te2'
_chemical_name_systematic        'Te2 O3 (S O4)'
_space_group_IT_number           31
_symmetry_space_group_name_Hall  'P -2ab 2ab'
_symmetry_space_group_name_H-M   'P 21 m n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.676
_cell_length_b                   8.911
_cell_length_c                   6.879
_cell_volume                     286.633
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Loub_ACBCAR_1976_585.cif
_cod_data_source_block           O7S1Te2
_cod_original_cell_volume        286.6331
_cod_original_sg_symbol_Hall     'P 2ac -2 (z,x,y)'
_cod_original_formula_sum        'O7 S1 Te2'
_cod_database_code               2107165
Electron-diffraction and x-ray diffraction study of rare earth metal oxides in thin films
Kashaev, A.A.; Ushchapovskii, L.V.; Il'in, A.G.; Soviet Physics, Crystallography (= Kristallografiya) 20 (1975) 114–115; doi:

data_1538649
_publ_section_title
;
 Electron-diffraction and x-ray diffraction study of rare earth metal
 oxides in thin films
;
_journal_name_full
'Soviet Physics, Crystallography (= Kristallografiya)'
_journal_page_first              114
_journal_page_last               115
_journal_volume                  20
_journal_year                    1975
_chemical_formula_sum            'Ho2 O3'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.18
_cell_length_b                   5.18
_cell_length_c                   5.18
_cell_volume                     138.992
_citation_journal_id_ASTM        SPHCA6
_cod_data_source_file            Kashaev_SPHCA6_1975_187.cif
_cod_data_source_block           Ho2O3
_cod_original_cell_volume        138.9918
_cod_database_code               1538649
Structure of K Ca P O4 H2 O from X-ray powder diffraction data
Louer, M.; Louer, D.; Plevert, J.; Acta Crystallographica B (39,1983-) 44 (1988) 463–467; doi:

data_2107166
_publ_section_title
;
 Structure of K Ca P O4 H2 O from X-ray powder diffraction data
;
_journal_name_full               'Acta Crystallographica B (39,1983-)'
_journal_page_first              463
_journal_page_last               467
_journal_volume                  44
_journal_year                    1988
_chemical_formula_sum            'Ca H2 K O5 P'
_chemical_name_systematic        'K Ca (P O4) (H2 O)'
_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                 102.975
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.5834
_cell_length_b                   8.1568
_cell_length_c                   7.6541
_cell_volume                     461.366
_citation_journal_id_ASTM        ASBSDK
_cod_data_source_file            Louer_ASBSDK_1988_1724.cif
_cod_data_source_block           H2Ca1K1O5P1
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2017-03-24
;
_cod_original_formula_sum        'H2 Ca1 K1 O5 P1'
_cod_database_code               2107166
Die Struktur des Erdalkalimetall-Oxocuprats, M10 Cu17 O29
Kato, K.; Takayama-Muromachi, E.; Kosuda, K.; Uchida, Y.; Acta Crystallographica C (39,1983-) 44 (1988) 1881–1884; doi:

data_2020193
_publ_section_title
;
 Die Struktur des Erdalkalimetall-Oxocuprats, M10 Cu17 O29
;
_journal_name_full               'Acta Crystallographica C (39,1983-)'
_journal_page_first              1881
_journal_page_last               1884
_journal_volume                  44
_journal_year                    1988
_chemical_formula_sum            'Bi0.31 Ca5.64 Cu17 O29 Sr4.05'
_chemical_name_systematic        'Bi.31 Ca5.64 Sr4.05 Cu17 O29'
_space_group_IT_number           22
_symmetry_space_group_name_Hall  'F 2 2'
_symmetry_space_group_name_H-M   'F 2 2 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.811
_cell_length_b                   11.3445
_cell_length_c                   19.5175
_cell_volume                     2836.564
_citation_journal_id_ASTM        ACSCEE
_cod_data_source_file            Kato_ACSCEE_1988_1612.cif
_cod_data_source_block           Bi0.31Ca5.64Cu17O29Sr4.05
_cod_database_code               2020193
Preparation of the monophosphides and monochalcogenides of uranium and thorium by the volatile metal process
Lovell, G.H.B.; Britz, E.J.; Perels, D.R.; Journal of Nuclear Materials 39 (1971) 303–310; doi:

data_1538650
_publ_section_title
;
 Preparation of the monophosphides and monochalcogenides of uranium and
 thorium by the volatile metal process
;
_journal_name_full               'Journal of Nuclear Materials'
_journal_page_first              303
_journal_page_last               310
_journal_volume                  39
_journal_year                    1971
_chemical_formula_sum            'P Th'
_chemical_name_systematic        'Th P'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.8324
_cell_length_b                   5.8324
_cell_length_c                   5.8324
_cell_volume                     198.400
_citation_journal_id_ASTM        JNUMAM
_cod_data_source_file            Lovell_JNUMAM_1971_1290.cif
_cod_data_source_block           P1Th1
_cod_original_cell_volume        198.4001
_cod_original_formula_sum        'P1 Th1'
_cod_database_code               1538650
The pyrosmalite group of minerals I: Structure refinemet of manganopyrosmalite
Kato, T.; Takeuchi, Y.; Canadian Mineralogist 21 (1983) 1–6; doi:

data_1538651
_publ_section_title
;
 The pyrosmalite group of minerals I: Structure refinemet of
 manganopyrosmalite
;
_journal_name_full               'Canadian Mineralogist'
_journal_page_first              1
_journal_page_last               6
_journal_volume                  21
_journal_year                    1983
_chemical_formula_sum            'Cl3 Fe3 H17 Mn13 O47 Si12'
_chemical_name_systematic        'Fe3 Mn13 (Si12 O30 (O H)17) Cl3'
_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_formula_units_Z            1
_cell_length_a                   13.422
_cell_length_b                   13.422
_cell_length_c                   7.165
_cell_volume                     1117.844
_citation_journal_id_ASTM        CAMIA6
_cod_data_source_file            Kato_CAMIA6_1983_1303.cif
_cod_data_source_block           H17Cl3Fe3Mn13O47Si12
_cod_original_formula_sum        'H17 Cl3 Fe3 Mn13 O47 Si12'
_cod_database_code               1538651
Preparation of the monophosphides and monochalcogenides of uranium and thorium by the volatile metal process
Lovell, G.H.B.; Perels, D.R.; Britz, E.J.; Journal of Nuclear Materials 39 (1971) 303–310; doi:

data_1538652
_publ_section_title
;
 Preparation of the monophosphides and monochalcogenides of uranium and
 thorium by the volatile metal process
;
_journal_name_full               'Journal of Nuclear Materials'
_journal_page_first              303
_journal_page_last               310
_journal_volume                  39
_journal_year                    1971
_chemical_formula_sum            'S Th'
_chemical_name_systematic        'Th S'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.671
_cell_length_b                   5.671
_cell_length_c                   5.671
_cell_volume                     182.381
_citation_journal_id_ASTM        JNUMAM
_cod_data_source_file            Lovell_JNUMAM_1971_1779.cif
_cod_data_source_block           S1Th1
_cod_original_cell_volume        182.3807
_cod_original_formula_sum        'S1 Th1'
_cod_database_code               1538652
Hydrazinium(2+) bis(trifluorostannate(II)) 65041-The synthesis and structure of heptacobalt tetrakis (hydrogenphosphate) bis(phosphate)
Kaucic, V.; Gaspersic-Skander, S.; Leban, I.; Gantar, D.; Rahten, A.; Acta Crystallographica C (39,1983-) 44 (1988) 1329–1331; doi:

data_2020194
_publ_section_title
;
 Hydrazinium(2+) bis(trifluorostannate(II)) 65041-The synthesis and
 structure of heptacobalt tetrakis (hydrogenphosphate) bis(phosphate)
;
_journal_name_full               'Acta Crystallographica C (39,1983-)'
_journal_page_first              1329
_journal_page_last               1331
_journal_volume                  44
_journal_year                    1988
_chemical_formula_sum            'F6 H6 N2 Sn2'
_chemical_name_systematic        '(N2 H6) (Sn F3)2'
_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                 108.55
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.581
_cell_length_b                   12.797
_cell_length_c                   5.771
_cell_volume                     740.825
_citation_journal_id_ASTM        ACSCEE
_cod_data_source_file            Kaucic_ACSCEE_1988_1644.cif
_cod_data_source_block           H6F6N2Sn2
_cod_original_cell_volume        740.8248
_cod_original_formula_sum        'H6 F6 N2 Sn2'
_cod_database_code               2020194
Preparation of the monophosphides and monochalcogenides of uranium and thorium by the volatile metal process
Lovell, G.H.B.; Perels, D.R.; Britz, E.J.; Journal of Nuclear Materials 39 (1971) 303–310; doi:

data_1538653
_publ_section_title
;
 Preparation of the monophosphides and monochalcogenides of uranium and
 thorium by the volatile metal process
;
_journal_name_full               'Journal of Nuclear Materials'
_journal_page_first              303
_journal_page_last               310
_journal_volume                  39
_journal_year                    1971
_chemical_formula_sum            'Se Th'
_chemical_name_systematic        'Th Se'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.785
_cell_length_b                   5.785
_cell_length_c                   5.785
_cell_volume                     193.602
_citation_journal_id_ASTM        JNUMAM
_cod_data_source_file            Lovell_JNUMAM_1971_1932.cif
_cod_data_source_block           Se1Th1
_cod_original_cell_volume        193.6021
_cod_original_formula_sum        'Se1 Th1'
_cod_database_code               1538653
Strontium disulphide prepared at high pressure
Kawada, I.; Kato, K.; Yamaoka, S.; Acta Crystallographica B (24,1968-38,1982) 32 (1976) 3110–3111; doi:

data_2107167
_publ_section_title
;
 Strontium disulphide prepared at high pressure
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              3110
_journal_page_last               3111
_journal_volume                  32
_journal_year                    1976
_chemical_formula_sum            'S2 Sr'
_chemical_name_systematic        'Sr S2'
_space_group_IT_number           140
_symmetry_space_group_name_Hall  '-I 4 2c'
_symmetry_space_group_name_H-M   'I 4/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.095
_cell_length_b                   6.095
_cell_length_c                   7.616
_cell_volume                     282.927
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Kawada_ACBCAR_1976_473.cif
_cod_data_source_block           S2Sr1
_cod_original_formula_sum        'S2 Sr1'
_cod_database_code               2107167
X-ray studies in the binary system Ni-S
Lundqvist, D.; Arkiv foer Kemi, Mineralogi och Geologi 24 (1947) 1–12; doi:

data_1538654
_publ_section_title
;
 X-ray studies in the binary system Ni-S
;
_journal_name_full               'Arkiv foer Kemi, Mineralogi och Geologi'
_journal_page_first              1
_journal_page_last               12
_journal_volume                  24
_journal_year                    1947
_chemical_formula_sum            'Ni S'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   3.425
_cell_length_b                   3.425
_cell_length_c                   5.34
_cell_volume                     54.249
_citation_journal_id_ASTM        AKMGAE
_cod_data_source_file            Lundqvist_AKMGAE_1947_997.cif
_cod_data_source_block           Ni1S1
_cod_original_cell_volume        54.24916
_cod_original_formula_sum        'Ni1 S1'
_cod_database_code               1538654
Crystal structures of V3 S4 and V5 S8
Kawada, I.; Nakano-Onoda, M.; Ishii, M.; Saeki, M.; Nakahira, M.; Journal of Solid State Chemistry 15 (1975) 246–252; doi:

data_1538655
_publ_section_title
;
 Crystal structures of V3 S4 and V5 S8
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              246
_journal_page_last               252
_journal_volume                  15
_journal_year                    1975
_chemical_formula_sum            'S4 V2.72'
_chemical_name_systematic        'V3 S4'
_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                 115.85
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.569
_cell_length_b                   3.267
_cell_length_c                   5.831
_cell_volume                     215.479
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Kawada_JSSCBI_1975_1809.cif
_cod_data_source_block           S4V2.72
_cod_original_cell_volume        215.4794
_cod_database_code               1538655
X-ray studies in the binary system Ni-S
Lundqvist, D.; Arkiv foer Kemi, Mineralogi och Geologi 24 (1947) 1–12; doi:

data_1538656
_publ_section_title
;
 X-ray studies in the binary system Ni-S
;
_journal_name_full               'Arkiv foer Kemi, Mineralogi och Geologi'
_journal_page_first              1
_journal_page_last               12
_journal_volume                  24
_journal_year                    1947
_chemical_formula_sum            'Ni S'
_space_group_IT_number           160
_symmetry_space_group_name_Hall  'P 3* -2'
_symmetry_space_group_name_H-M   'R 3 m :R'
_cell_angle_alpha                116.62
_cell_angle_beta                 116.62
_cell_angle_gamma                116.62
_cell_formula_units_Z            3
_cell_length_a                   5.64
_cell_length_b                   5.64
_cell_length_c                   5.64
_cell_volume                     83.723
_citation_journal_id_ASTM        AKMGAE
_cod_data_source_file            Lundqvist_AKMGAE_1947_998.cif
_cod_data_source_block           Ni1S1
_cod_original_cell_volume        83.72328
_cod_original_sg_symbol_Hall     'R 3 -2" (-y+z,x+z,-x+y+z)'
_cod_original_formula_sum        'Ni1 S1'
_cod_database_code               1538656
Crystal structure of dipotassium pentasulphide
Kelly, B.; Woodward, P.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1976 (1976) 1314–1316; doi:

data_4031665
_publ_section_title
;
 Crystal structure of dipotassium pentasulphide
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              1314
_journal_page_last               1316
_journal_volume                  1976
_journal_year                    1976
_chemical_formula_sum            'K2 S5'
_space_group_IT_number           19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.6
_cell_length_b                   17.414
_cell_length_c                   6.494
_cell_volume                     746.371
_citation_journal_id_ASTM        JCDTBI
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