LMucko/crystallography-open-database huggingface dataset:
The crystal structure of the compound V Cr2 C2
Telegus, V.S.; Kuz'ma, Yu.B.; Kripyakevich, P.I.; Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Tekhnichni ta Matematichni Nauki 1967 (1967) 545–546; doi:

data_1530865
_publ_section_title
;
 The crystal structure of the compound V Cr2 C2
;
_journal_name_full
;
Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Tekhnichni ta 
Matematichni Nauki
;
_journal_page_first              545
_journal_page_last               546
_journal_volume                  1967
_journal_year                    1967
_chemical_formula_sum            'C2 Cr2 V'
_chemical_name_systematic        'Cr2 V C2'
_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                   2.854
_cell_length_b                   9.284
_cell_length_c                   6.999
_cell_volume                     185.449
_citation_journal_id_ASTM        DUKABM
_cod_data_source_file            Telegus_DUKABM_1967_1820.cif
_cod_data_source_block           C2Cr2V1
_cod_original_cell_volume        185.4493
_cod_original_formula_sum        'C2 Cr2 V1'
_cod_database_code               1530865
Dependence of the (Fe (C O)4)(2-) geometry on counterion: crystal structures of K2 Fe (C O)4 and (Na(Crypt))2(Fe (C O)4) (Crypt=N(CH2CH2OCH2CH2OCH2CH2)3N)
Teller, R.G.; Finke, R.G.; Bau, R.; Collman, J.P.; Chin, H.B.; Journal of the American Chemical Society 99 (1977) 1104–1111; doi:

data_4124469
_publ_section_title
;
 Dependence of the (Fe (C O)4)(2-) geometry on counterion: crystal
 structures of K2 Fe (C O)4 and (Na(Crypt))2(Fe (C O)4)
 (Crypt=N(CH2CH2OCH2CH2OCH2CH2)3N)
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              1104
_journal_page_last               1111
_journal_volume                  99
_journal_year                    1977
_chemical_formula_sum            'C4 Fe K2 O4'
_chemical_name_systematic        'K2 Fe (C O)4'
_space_group_IT_number           70
_symmetry_space_group_name_Hall  '-F 2uv 2vw'
_symmetry_space_group_name_H-M   'F d d d :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   23.072
_cell_length_b                   11.557
_cell_length_c                   5.543
_cell_volume                     1478.003
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Teller_JACSAT_1977_124.cif
_cod_data_source_block           C4Fe1K2O4
_cod_original_formula_sum        'C4 Fe1 K2 O4'
_cod_database_code               4124469
Hydrogen bond studies 109. A neutron diffraction study of the paraelectric phase of rubidium trihydrogen selenite, Rb H3 (Se O3)2
Tellgren, R.; Liminga, R.; Ferroelectrics 15 (1977) 15–20; doi:

data_1530866
_publ_section_title
;
 Hydrogen bond studies 109. A neutron diffraction study of the
 paraelectric phase of rubidium trihydrogen selenite, Rb H3 (Se O3)2
;
_journal_name_full               Ferroelectrics
_journal_page_first              15
_journal_page_last               20
_journal_volume                  15
_journal_year                    1977
_chemical_formula_sum            'H3 O6 Rb Se2'
_chemical_name_systematic        'Rb H3 (Se O3)2'
_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                   5.9192
_cell_length_b                   17.9506
_cell_length_c                   6.2519
_cell_volume                     664.284
_citation_journal_id_ASTM        FEROA8
_cod_data_source_file            Tellgren_FEROA8_1977_119.cif
_cod_data_source_block           H3O6Rb1Se2
_cod_original_cell_volume        664.2843
_cod_original_formula_sum        'H3 O6 Rb1 Se2'
_cod_database_code               1530866
Synthesis and structural characterization of the molecular complex (Ru (C O)3 Cl2)2 (Sb Cl3)
Teulon, P.; Roziere, J.; Journal of Organometallic Chemistry 214 (1981) 391–397; doi:

data_4031500
_publ_section_title
;
 Synthesis and structural characterization of the molecular complex (Ru (C
 O)3 Cl2)2 (Sb Cl3)
;
_journal_name_full               'Journal of Organometallic Chemistry'
_journal_page_first              391
_journal_page_last               397
_journal_volume                  214
_journal_year                    1981
_chemical_formula_sum            'C6 Cl7 O6 Ru2 Sb'
_chemical_name_systematic        '(Ru (C O)3 Cl2)2 (Sb Cl3)'
_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                 100.31
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.289
_cell_length_b                   11.986
_cell_length_c                   16.932
_cell_volume                     1854.736
_citation_journal_id_ASTM        JORCAI
_cod_data_source_file            Teulon_JORCAI_1981_623.cif
_cod_data_source_block           C6Cl7O6Ru2Sb1
_cod_original_formula_sum        'C6 Cl7 O6 Ru2 Sb1'
_cod_database_code               4031500
Structural refinement of delithiated Li V O2 by neutron diffraction
Thackeray, M.M.; de Picciotto, L.A.; Goodenough, J.B.; Bruce, P.G.; David, W.I.F.; Journal of Solid State Chemistry 67 (1987) 285–290; doi:

data_1530867
_publ_section_title
;
 Structural refinement of delithiated Li V O2 by neutron diffraction
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              285
_journal_page_last               290
_journal_volume                  67
_journal_year                    1987
_chemical_formula_sum            'Li0.19 O2 V'
_chemical_name_systematic        'Li.19 V O2'
_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            3
_cell_length_a                   2.878
_cell_length_b                   2.878
_cell_length_c                   14.189
_cell_volume                     101.780
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Thackeray_JSSCBI_1987_1402.cif
_cod_data_source_block           Li0.19O2V1
_cod_original_cell_volume        101.7804
_cod_original_formula_sum        'Li0.19 O2 V1'
_cod_database_code               1530867
The structure of Koechlinite bismuth molybdate. A controversy resolved by neutron diffraction
Theobald, F.R.; Laarif, A.; Hewat, A.W.; Ferroelectrics 56 (1984) 219–237; doi:

data_1530868
_publ_section_title
;
 The structure of Koechlinite bismuth molybdate. A controversy resolved by
 neutron diffraction
;
_journal_name_full               Ferroelectrics
_journal_page_first              219
_journal_page_last               237
_journal_volume                  56
_journal_year                    1984
_chemical_formula_sum            'Bi2 Mo O6'
_space_group_IT_number           29
_symmetry_space_group_name_Hall  'P 2c -2ac'
_symmetry_space_group_name_H-M   'P c a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.4896
_cell_length_b                   16.22658
_cell_length_c                   5.5131
_cell_volume                     491.093
_citation_journal_id_ASTM        FEROA8
_cod_data_source_file            Theobald_FEROA8_1984_1099.cif
_cod_data_source_block           Bi2Mo1O6
_cod_original_cell_volume        491.0928
_cod_original_formula_sum        'Bi2 Mo1 O6'
_cod_database_code               1530868
Crystal Growth, Structure, Electron Paramagnetic Resonance and Magnetic Properties of (N H4)2 V3 O8
Theobald, F.R.; Theobald, J.G.; Vedrine, J.C.; Clad, R.; Renard, J.; Journal of Physics and Chemistry of Solids 45 (1984) 581–587; doi:

data_1530869
_publ_section_title
;
 Crystal Growth, Structure, Electron Paramagnetic Resonance and Magnetic
 Properties of (N H4)2 V3 O8
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              581
_journal_page_last               587
_journal_volume                  45
_journal_year                    1984
_chemical_formula_sum            'H8 N2 O8 V3'
_chemical_name_systematic        '(N H4)2 V3 O8'
_space_group_IT_number           100
_symmetry_space_group_name_Hall  'P 4 -2ab'
_symmetry_space_group_name_H-M   'P 4 b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.891
_cell_length_b                   8.891
_cell_length_c                   5.582
_cell_volume                     441.256
_citation_journal_id_ASTM        JPCSAW
_cod_data_source_file            Theobald_JPCSAW_1984_1237.cif
_cod_data_source_block           H8N2O8V3
_cod_original_cell_volume        441.2564
_cod_database_code               1530869
Essai sur la structure de V O2 (B)
Theobald, F.R.; Bernard, J.; Cabala, R.; Journal of Solid State Chemistry 17 (1976) 431–438; doi:

data_1530870
_publ_section_title
;
 Essai sur la structure de V O2 (B)
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              431
_journal_page_last               438
_journal_volume                  17
_journal_year                    1976
_chemical_formula_sum            'O2 V'
_chemical_name_systematic        'V O2'
_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                 106.1
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.03
_cell_length_b                   3.693
_cell_length_c                   6.42
_cell_volume                     274.033
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Theobald_JSSCBI_1976_93.cif
_cod_data_source_block           O2V1
_cod_original_cell_volume        274.0334
_cod_original_formula_sum        'O2 V1'
_cod_database_code               1530870
An X-Ray film powder profile refinement of the crystal structure of Ta5 P3
Thomas, J.O.; Ersson, N.O.; Andersson, Y.; Journal of Applied Crystallography 13 (1980) 605–607; doi:

data_2300530
_publ_section_title
;
 An X-Ray film powder profile refinement of the crystal structure of Ta5
 P3
;
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              605
_journal_page_last               607
_journal_volume                  13
_journal_year                    1980
_chemical_formula_sum            'P3 Ta5'
_chemical_name_systematic        'Ta5 P3'
_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            8
_cell_length_a                   25.321
_cell_length_b                   3.4013
_cell_length_c                   11.4614
_cell_volume                     987.105
_citation_journal_id_ASTM        JACGAR
_cod_data_source_file            Thomas_JACGAR_1980_561.cif
_cod_data_source_block           P3Ta5
_cod_original_cell_volume        987.1052
_cod_database_code               2300530
The crystal structure and absolute optical chirality of paratellurite, alpha-Te O2
Thomas, P.A.; Journal of Physics C 21 (1988) 4611–4627; doi:

data_1530871
_publ_section_title
;
 The crystal structure and absolute optical chirality of paratellurite,
 alpha-Te O2
;
_journal_name_full               'Journal of Physics C'
_journal_page_first              4611
_journal_page_last               4627
_journal_volume                  21
_journal_year                    1988
_chemical_formula_sum            'O2 Te'
_chemical_name_systematic        'Te O2'
_space_group_IT_number           92
_symmetry_space_group_name_Hall  'P 4abw 2nw'
_symmetry_space_group_name_H-M   'P 41 21 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.8082
_cell_length_b                   4.8082
_cell_length_c                   7.612
_cell_volume                     175.980
_citation_journal_id_ASTM        JPSOAW
_cod_data_source_file            Thomas_JPSOAW_1988_1728.cif
_cod_data_source_block           O2Te1
_cod_original_cell_volume        175.9802
_cod_original_formula_sum        'O2 Te1'
_cod_database_code               1530871
The composition and proposed structure of the alkali metal layered molybdenum bronzes
Thomas, D.M.; McCarron, E.M.; Materials Research Bulletin 21 (1986) 945–960; doi:

data_1530872
_publ_section_title
;
 The composition and proposed structure of the alkali metal layered
 molybdenum bronzes
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              945
_journal_page_last               960
_journal_volume                  21
_journal_year                    1986
_chemical_formula_sum            'H Mo Na0.25 O3.5'
_chemical_name_systematic        '(Na (H2 O)2)0.25 (Mo O3)'
_space_group_IT_number           35
_symmetry_space_group_name_Hall  'A -2 2'
_symmetry_space_group_name_H-M   'A 2 m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   3.876
_cell_length_b                   19.093
_cell_length_c                   3.733
_cell_volume                     276.259
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Thomas_MRBUAC_1986_1302.cif
_cod_data_source_block           H1Mo1Na0.25O3.5
_cod_original_cell_volume        276.2587
_cod_original_sg_symbol_Hall     'C 2 -2 (z,x,y)'
_cod_original_formula_sum        'H1 Mo1 Na0.25 O3.5'
_cod_database_code               1530872
Neutron diffraction study of gamma iron titanium deuteride
Thompson, P.; Reilly, J.J.; Reidinger, F.; Hastings, J.M.; Corliss, L.M.; Journal of Physics F 9 (1979) 61–66; doi:

data_1530873
_publ_section_title
;
 Neutron diffraction study of gamma iron titanium deuteride
;
_journal_name_full               'Journal of Physics F'
_journal_page_first              61
_journal_page_last               66
_journal_volume                  9
_journal_year                    1979
_chemical_formula_sum            'D1.93 Fe Ti'
_chemical_name_systematic        'Fe Ti D1.93'
_space_group_IT_number           10
_symmetry_space_group_name_Hall  '-P 2y'
_symmetry_space_group_name_H-M   'P 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 96.97
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.7044
_cell_length_b                   2.8301
_cell_length_c                   4.7044
_cell_volume                     62.171
_citation_journal_id_ASTM        JPFMAT
_cod_data_source_file            Thompson_JPFMAT_1979_454.cif
_cod_data_source_block           D1.93Fe1Ti1
_cod_original_cell_volume        62.17114
_cod_original_formula_sum        'D1.93 Fe1 Ti1'
_cod_database_code               1530873
A neutron diffraction study of La Co O3 in the temperature range 4.2 < T < 1248 K
Thornton, G.; Tofield, B.C.; Hewat, A.W.; Journal of Solid State Chemistry 61 (1986) 301–307; doi:

data_1530874
_publ_section_title
;
 A neutron diffraction study of La Co O3 in the temperature range 4.2 < T
 < 1248 K
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              301
_journal_page_last               307
_journal_volume                  61
_journal_year                    1986
_chemical_formula_sum            'Co La O3'
_chemical_name_systematic        'La Co O3'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-P 3* 2n'
_symmetry_space_group_name_H-M   'R -3 c :R'
_cell_angle_alpha                60.99
_cell_angle_beta                 60.99
_cell_angle_gamma                60.99
_cell_formula_units_Z            2
_cell_length_a                   5.3416
_cell_length_b                   5.3416
_cell_length_c                   5.3416
_cell_volume                     110.174
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Thornton_JSSCBI_1986_1141.cif
_cod_data_source_block           Co1La1O3
_cod_original_cell_volume        110.1737
_cod_original_sg_symbol_Hall     '-R 3 2"c (-y+z,x+z,-x+y+z)'
_cod_original_formula_sum        'Co1 La1 O3'
_cod_database_code               1530874
Structure cristalline du chlorodioxoantimoniate de baryum Ba Sb O2 Cl
Thuillier-Chevin, F.; Maraine, P.; Perez, G.; Revue de Chimie Minerale 17 (1980) 102–109; doi:

data_1530875
_publ_section_title
;
 Structure cristalline du chlorodioxoantimoniate de baryum Ba Sb O2 Cl
;
_journal_name_full               'Revue de Chimie Minerale'
_journal_page_first              102
_journal_page_last               109
_journal_volume                  17
_journal_year                    1980
_chemical_formula_sum            'Ba Cl O2 Sb'
_chemical_name_systematic        'Ba Sb O2 Cl'
_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                   5.849
_cell_length_b                   12.793
_cell_length_c                   5.514
_cell_volume                     412.592
_citation_journal_id_ASTM        RVCMA8
_cod_data_source_file            Thuillier-Chevin_RVCMA8_1980_660.cif
_cod_data_source_block           Ba1Cl1O2Sb1
_cod_original_formula_sum        'Ba1 Cl1 O2 Sb1'
_cod_database_code               1530875
The crystal structure of tetragonal K H2 P O4 and K D2 P O4 as a function of temperature and pressure
Tibballs, J.E.; Nelmes, R.J.; McIntyre, G.J.; Journal of Physics C 15 (1982) 37–58; doi:

data_1530876
_publ_section_title
;
 The crystal structure of tetragonal K H2 P O4 and K D2 P O4 as a function
 of temperature and pressure
;
_journal_name_full               'Journal of Physics C'
_journal_page_first              37
_journal_page_last               58
_journal_volume                  15
_journal_year                    1982
_chemical_formula_sum            'D2 K O4 P'
_chemical_name_systematic        'K (D2 P O4)'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.469
_cell_length_b                   7.469
_cell_length_c                   6.976
_cell_volume                     389.163
_citation_journal_id_ASTM        JPSOAW
_cod_data_source_file            Tibballs_JPSOAW_1982_923.cif
_cod_data_source_block           D2K1O4P1
_cod_original_cell_volume        389.1628
_cod_original_formula_sum        'D2 K1 O4 P1'
_cod_database_code               1530876
Structure cristalline de Rb Sb2 F7
Tichit, D.; Ducourant, M.B.; Fourcade, R.; Mascherpa, G.; Journal of Fluorine Chemistry 13 (1979) 45–53; doi:

data_1530877
_publ_section_title
;
 Structure cristalline de Rb Sb2 F7
;
_journal_name_full               'Journal of Fluorine Chemistry'
_journal_page_first              45
_journal_page_last               53
_journal_volume                  13
_journal_year                    1979
_chemical_formula_sum            'F7 Rb Sb2'
_chemical_name_systematic        'Rb Sb2 F7'
_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                 102.4
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.588
_cell_length_b                   6.587
_cell_length_c                   8.889
_cell_volume                     719.857
_citation_journal_id_ASTM        JFLCAR
_cod_data_source_file            Tichit_JFLCAR_1979_444.cif
_cod_data_source_block           F7Rb1Sb2
_cod_original_cell_volume        719.8569
_cod_original_formula_sum        'F7 Rb1 Sb2'
_cod_database_code               1530877
The crystal and molecular structure of oxovanadium(V) orthophosphate dihydrate, V O P O4 (H2 O)2
Tietze, H.R.; Australian Journal of Chemistry 34 (1981) 2035–2038; doi:

data_1530878
_publ_section_title
;
 The crystal and molecular structure of oxovanadium(V) orthophosphate
 dihydrate, V O P O4 (H2 O)2
;
_journal_name_full               'Australian Journal of Chemistry'
_journal_page_first              2035
_journal_page_last               2038
_journal_volume                  34
_journal_year                    1981
_chemical_formula_sum            'H4 O7 P V'
_chemical_name_systematic        '(V O) (P O4) (H2 O)2'
_space_group_IT_number           129
_symmetry_space_group_name_Hall  '-P 4a 2a'
_symmetry_space_group_name_H-M   'P 4/n m m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.202
_cell_length_b                   6.202
_cell_length_c                   7.41
_cell_volume                     285.024
_citation_journal_id_ASTM        AJCHAS
_cod_data_source_file            Tietze_AJCHAS_1981_616.cif
_cod_data_source_block           H4O7P1V1
_cod_original_cell_volume        285.0242
_cod_original_formula_sum        'H4 O7 P1 V1'
_cod_database_code               1530878
Computer Simulation of Crystal Structures applied to the Solution of the Superstructure of Cubic Silicon-diphosphate
Tillmanns, E.; Baur, W.H.; Gebert, W.; Journal of Solid State Chemistry 7 (1973) 69–84; doi:

data_1530879
_publ_section_title
;
 Computer Simulation of Crystal Structures applied to the Solution of the
 Superstructure of Cubic Silicon-diphosphate
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              69
_journal_page_last               84
_journal_volume                  7
_journal_year                    1973
_chemical_formula_sum            'O7 P2 Si'
_chemical_name_systematic        'Si (P2 O7)'
_space_group_IT_number           205
_symmetry_space_group_name_Hall  '-P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P a -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.473
_cell_length_b                   7.473
_cell_length_c                   7.473
_cell_volume                     417.335
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Tillmanns_JSSCBI_1973_12.cif
_cod_data_source_block           O7P2Si1
_cod_original_cell_volume        417.3351
_cod_original_formula_sum        'O7 P2 Si1'
_cod_database_code               1530879