LMucko/crystallography-open-database huggingface dataset:
Kristallstruktur von Zn Sn As2
Pfister, H.; Acta Crystallographica (1,1948-23,1967) 16 (1963) 153–153; doi:

data_2310651
_publ_section_title
;
 Kristallstruktur von Zn Sn As2
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              153
_journal_page_last               153
_journal_volume                  16
_journal_year                    1963
_chemical_formula_sum            'As2 Sn Zn'
_chemical_name_systematic        'Zn Sn As2'
_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                   5.851
_cell_length_b                   5.851
_cell_length_c                   11.702
_cell_volume                     400.609
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Pfister_ACCRA9_1963_1902.cif
_cod_data_source_block           As2Sn1Zn1
_cod_original_cell_volume        400.6086
_cod_original_formula_sum        'As2 Sn1 Zn1'
_cod_database_code               2310651
Structures cristallines des phases Fe3 Ga4 et Cr3 Ga4
Philippe, M.J.; Roques, B.; Malaman, B.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 477–482; doi:

data_2106579
_publ_section_title
;
 Structures cristallines des phases Fe3 Ga4 et Cr3 Ga4
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              477
_journal_page_last               482
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Fe3 Ga4'
_chemical_name_systematic        'Ga4 Fe3'
_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                 106.66
_cell_angle_gamma                90
_cell_formula_units_Z            6
_cell_length_a                   10.091
_cell_length_b                   7.666
_cell_length_c                   7.866
_cell_volume                     582.952
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Philippe_ACBCAR_1975_1909.cif
_cod_data_source_block           Fe3Ga4
_cod_database_code               2106579
Structures cristallines des phases Fe3 Ga4 et Cr3 Ga4
Philippe, M.J.; Roques, B.; Malaman, B.; Protas, J.; Courtois, A.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 477–482; doi:

data_2106580
_publ_section_title
;
 Structures cristallines des phases Fe3 Ga4 et Cr3 Ga4
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              477
_journal_page_last               482
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Cr3 Ga4'
_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
_cell_angle_gamma                90
_cell_formula_units_Z            6
_cell_length_a                   10.135
_cell_length_b                   7.845
_cell_length_c                   7.986
_cell_volume                     610.362
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Philippe_ACBCAR_1975_1910.cif
_cod_data_source_block           Cr3Ga4
_cod_original_cell_volume        610.3622
_cod_database_code               2106580
Structural study of [(C H3)2 N H2]2 Co Cl4 single crystals at room temperature
Pietraszko, A.; Sheleg, A.U.; Kirpichnikova, L.F.; Yachkovsky, A.Y.; Kristallografiya 51 (2006) 41–43; doi:

data_1528799
_publ_section_title
;
 Structural study of [(C H3)2 N H2]2 Co Cl4 single crystals at room
 temperature
;
_journal_name_full               Kristallografiya
_journal_page_first              41
_journal_page_last               43
_journal_volume                  51
_journal_year                    2006
_chemical_formula_sum            'C4 H16 Cl4 Co N2'
_chemical_name_systematic        '((C H3)2 N H2)2 (Co Cl4)'
_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                 90.1
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.545
_cell_length_b                   11.447
_cell_length_c                   13.313
_cell_volume                     1302.204
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Pietraszko_KRISAJ_2006_759.cif
_cod_data_source_block           C4H16Cl4Co1N2
_cod_original_formula_sum        'C4 H16 Cl4 Co1 N2'
_cod_database_code               1528799
Phurcalite
Piret, P.; Declercq, J.P.; Acta Crystallographica B (24,1968-38,1982) 34 (1978) 1677–1679; doi:

data_2106581
_publ_section_title
;
 Phurcalite
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1677
_journal_page_last               1679
_journal_volume                  34
_journal_year                    1978
_chemical_formula_sum            'Ca2 H12 O22 P2 U3'
_chemical_name_systematic        'Ca2 (U O2)3 (P O4)2 (O H)4 (H2 O)4'
_space_group_IT_number           61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   17.426
_cell_length_b                   16.062
_cell_length_c                   13.592
_cell_volume                     3804.352
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Piret_ACBCAR_1978_331.cif
_cod_data_source_block           H12Ca2O22P2U3
_cod_original_formula_sum        'H12 Ca2 O22 P2 U3'
_cod_database_code               2106581
Crystal structures, electronic properties and pressure induced superconductivity of the tetrahedral cluster compounds Ga Nb4 S8, Ga Nb4 Se8 and Ga Ta4 Se8
Pocha, R.; Ni, B.; Johrendt, D.; Abd-Elmeguid, M.M.; Journal of the American Chemical Society 127 (2005) 8732–8740; doi:

data_4124107
_publ_section_title
;
 Crystal structures, electronic properties and pressure induced
 superconductivity of the tetrahedral cluster compounds Ga Nb4 S8, Ga Nb4
 Se8 and Ga Ta4 Se8
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              8732
_journal_page_last               8740
_journal_volume                  127
_journal_year                    2005
_chemical_formula_sum            'Ga Se8 Ta4'
_chemical_name_systematic        'Ga Ta4 Se8'
_space_group_IT_number           216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.201
_cell_length_b                   10.201
_cell_length_c                   10.201
_cell_volume                     1061.520
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Pocha_JACSAT_2005_593.cif
_cod_data_source_block           Ga1Se8Ta4
_cod_original_cell_volume        1061.52
_cod_original_formula_sum        'Ga1 Se8 Ta4'
_cod_database_code               4124107
Synthesis, spectroscopic and X-ray structure characterisation of bis(tetramethylammonium) and bis(tetra-n-butylammonium) tetrathiomolybdates
Poisot, M.; Naether, C.; Bensch, W.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 62 (2007) 209–214; doi:

data_7221503
_publ_section_title
;
 Synthesis, spectroscopic and X-ray structure characterisation of
 bis(tetramethylammonium) and bis(tetra-n-butylammonium)
 tetrathiomolybdates
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              209
_journal_page_last               214
_journal_volume                  62
_journal_year                    2007
_chemical_formula_sum            'C8 H24 Mo N2 S4'
_chemical_name_systematic        '((C H3)4 N)2 (Mo S4)'
_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            12
_cell_length_a                   8.9233
_cell_length_b                   15.521
_cell_length_c                   37.255
_cell_volume                     5159.763
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Poisot_ZNBSEN_2007_1194.cif
_cod_data_source_block           C8H24Mo1N2S4
_cod_original_formula_sum        'C8 H24 Mo1 N2 S4'
_cod_database_code               7221503
On the structure of anhydrous nickel sulfate
Poljak, R.J.; Acta Crystallographica (1,1948-23,1967) 11 (1958) 306–306; doi:

data_2310652
_publ_section_title
;
 On the structure of anhydrous nickel sulfate
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              306
_journal_page_last               306
_journal_volume                  11
_journal_year                    1958
_chemical_formula_sum            'Ni O4 S'
_chemical_name_systematic        'Ni (S O4)'
_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                   5.155
_cell_length_b                   7.842
_cell_length_c                   6.338
_cell_volume                     256.217
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Poljak_ACCRA9_1958_260.cif
_cod_data_source_block           Ni1O4S1
_cod_original_cell_volume        256.2169
_cod_original_formula_sum        'Ni1 O4 S1'
_cod_database_code               2310652
A structural study of a nonstoichiometric niobium-zirconium oxyfluoride with the Re O3 type structure
Poulain, M.; Lucas, J.; Tilley, R.J.D.; Journal of Solid State Chemistry 17 (1976) 331–337; doi:

data_1528800
_publ_section_title
;
 A structural study of a nonstoichiometric niobium-zirconium oxyfluoride
 with the Re O3 type structure
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              331
_journal_page_last               337
_journal_volume                  17
_journal_year                    1976
_chemical_formula_sum            'F1.8 Nb0.55 O1.1 Zr0.45'
_chemical_name_systematic        '(Nb0.55 Zr0.45) (O1.1 F1.8)'
_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                   3.94
_cell_length_b                   3.94
_cell_length_c                   3.94
_cell_volume                     61.163
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Poulain_JSSCBI_1976_1981.cif
_cod_data_source_block           F1.8Nb0.55O1.1Zr0.45
_cod_original_cell_volume        61.16299
_cod_database_code               1528800
Synchrotron x-ray charge-density study of coordination polymer [Mn (H C O O)2 (H2 O)2](infinite)
Poulsen, R.D.; Overgaard, J.; Jorgensen, M.R.V.; Iversen, B.B.; Morgenroth, W.; Larsen, F.K.; Graber, T.; Chen Yusheng; Chemistry - A European Journal 13 (2007) 9775–9790; doi:

data_1528801
_publ_section_title
;
 Synchrotron x-ray charge-density study of coordination polymer [Mn (H C O
 O)2 (H2 O)2](infinite)
;
_journal_name_full               'Chemistry - A European Journal'
_journal_page_first              9775
_journal_page_last               9790
_journal_volume                  13
_journal_year                    2007
_chemical_formula_sum            'C2 H6 Mn O6'
_chemical_name_systematic        '(Mn (H C O O)2 (H2 O)2)'
_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                 97.693
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.808
_cell_length_b                   7.2136
_cell_length_c                   9.6203
_cell_volume                     605.747
_citation_journal_id_ASTM        CEUJED
_cod_data_source_file            Poulsen_CEUJED_2007_1326.cif
_cod_data_source_block           C2H6Mn1O6
_cod_original_cell_volume        605.7473
_cod_original_formula_sum        'C2 H6 Mn1 O6'
_cod_database_code               1528801
Ueber die Kristallstruktur des Julienite, Na2 Co (N C S)4 (H2 O)8
Preisinger, A.; Mineralogische und Petrographische Mitteilungen 3 (1953) 376–380; doi:

data_1528802
_publ_section_title
;
 Ueber die Kristallstruktur des Julienite, Na2 Co (N C S)4 (H2 O)8
;
_journal_name_full
'Mineralogische und Petrographische Mitteilungen'
_journal_page_first              376
_journal_page_last               380
_journal_volume                  3
_journal_year                    1953
_chemical_formula_sum            'C4 H16 Co N4 Na2 O8 S4'
_chemical_name_systematic        'Na2 Co (N C S)4 (H2 O)8'
_space_group_IT_number           81
_symmetry_space_group_name_Hall  'P -4'
_symmetry_space_group_name_H-M   'P -4'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   19
_cell_length_b                   19
_cell_length_c                   5.47
_cell_volume                     1974.670
_citation_journal_id_ASTM        MPMIAH
_cod_data_source_file            Preisinger_MPMIAH_1953_312.cif
_cod_data_source_block           C4H16Co1N4Na2O8S4
_cod_original_cell_volume        1974.67
_cod_original_formula_sum        'C4 H16 Co1 N4 Na2 O8 S4'
_cod_database_code               1528802
Germanium and silicon disulfides: Structure and synthesis
Prewitt, C.T.; Young, H.S.; Science 149 (1965) 535–537; doi:

data_1528803
_publ_section_title
;
 Germanium and silicon disulfides: Structure and synthesis
;
_journal_name_full               Science
_journal_page_first              535
_journal_page_last               537
_journal_volume                  149
_journal_year                    1965
_chemical_formula_sum            'Ge S2'
_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                   5.48
_cell_length_b                   5.48
_cell_length_c                   9.143
_cell_volume                     274.568
_citation_journal_id_ASTM        SCIEAS
_cod_data_source_file            Prewitt_SCIEAS_1965_386.cif
_cod_data_source_block           Ge1S2
_cod_original_cell_volume        274.5679
_cod_original_formula_sum        'Ge1 S2'
_cod_database_code               1528803
Germanium and silicon disulfides: Structure and synthesis
Prewitt, C.T.; Young, H.S.; Science 149 (1965) 535–537; doi:

data_1528804
_publ_section_title
;
 Germanium and silicon disulfides: Structure and synthesis
;
_journal_name_full               Science
_journal_page_first              535
_journal_page_last               537
_journal_volume                  149
_journal_year                    1965
_chemical_formula_sum            'S2 Si'
_chemical_name_systematic        'Si S2'
_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                   5.42
_cell_length_b                   5.42
_cell_length_c                   8.718
_cell_volume                     256.103
_citation_journal_id_ASTM        SCIEAS
_cod_data_source_file            Prewitt_SCIEAS_1965_387.cif
_cod_data_source_block           S2Si1
_cod_original_cell_volume        256.1035
_cod_original_formula_sum        'S2 Si1'
_cod_database_code               1528804
Crystal and magnetic structure of copper chromite
Prince, E.; Acta Crystallographica (1,1948-23,1967) 10 (1957) 554–556; doi:

data_2310653
_publ_section_title
;
 Crystal and magnetic structure of copper chromite
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              554
_journal_page_last               556
_journal_volume                  10
_journal_year                    1957
_chemical_formula_sum            'Cr2 Cu O4'
_chemical_name_systematic        'Cu Cr2 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                   6.04
_cell_length_b                   6.04
_cell_length_c                   7.78
_cell_volume                     283.827
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Prince_ACCRA9_1957_245.cif
_cod_data_source_block           Cr2Cu1O4
_cod_original_cell_volume        283.8268
_cod_original_formula_sum        'Cr2 Cu1 O4'
_cod_database_code               2310653
Synthesis and structural characterization of new rhodium formato complexes containing [Rh2](4+) and [Rh4](6+) cores
Pruchnik, F.P.; Jutarska, A.; Ciunik, Z.; Pruchnik, M.; Inorganica Chimica Acta 350 (2003) 609–616; doi:

data_1528805
_publ_section_title
;
 Synthesis and structural characterization of new rhodium formato
 complexes containing [Rh2](4+) and [Rh4](6+) cores
;
_journal_name_full               'Inorganica Chimica Acta'
_journal_page_first              609
_journal_page_last               616
_journal_volume                  350
_journal_year                    2003
_chemical_formula_sum            'C10 H18 N2 O10 Rh2'
_chemical_name_systematic        'Rh2 (O O C H)4 ((C H3)2 N C H O)2'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                97.212
_cell_angle_beta                 98.846
_cell_angle_gamma                112.15
_cell_formula_units_Z            1
_cell_length_a                   6.5093
_cell_length_b                   7.2242
_cell_length_c                   9.7406
_cell_volume                     410.682
_citation_journal_id_ASTM        ICHAA3
_cod_data_source_file            Pruchnik_ICHAA3_2003_1017.cif
_cod_data_source_block           C10H18N2O10Rh2
_cod_original_cell_volume        410.6817
_cod_database_code               1528805
Synthesis and structural characterization of new rhodium formato complexes containing [Rh2](4+) and [Rh4](6+) cores
Pruchnik, F.P.; Jutarska, A.; Ciunik, Z.; Pruchnik, M.; Inorganica Chimica Acta 350 (2003) 609–616; doi:

data_1528806
_publ_section_title
;
 Synthesis and structural characterization of new rhodium formato
 complexes containing [Rh2](4+) and [Rh4](6+) cores
;
_journal_name_full               'Inorganica Chimica Acta'
_journal_page_first              609
_journal_page_last               616
_journal_volume                  350
_journal_year                    2003
_chemical_formula_sum            'C5 H9 Na O12 Rh2'
_chemical_name_systematic        'Na (Rh2 (O O C H)4 (O O C H) (H2 O)) (H2 O)'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 92.55
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.67
_cell_length_b                   10.954
_cell_length_c                   16.751
_cell_volume                     1222.669
_citation_journal_id_ASTM        ICHAA3
_cod_data_source_file            Pruchnik_ICHAA3_2003_1018.cif
_cod_data_source_block           C5H9Na1O12Rh2
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'C5 H9 Na1 O12 Rh2'
_cod_database_code               1528806
Quecksilberschwefelfluoride
Puff, H.; Heine, D.; Lieck, G.; Naturwissenschaften 55 (1968) 298–298; doi:

data_1528807
_publ_section_title
;
 Quecksilberschwefelfluoride
;
_journal_name_full               Naturwissenschaften
_journal_page_first              298
_journal_page_last               298
_journal_volume                  55
_journal_year                    1968
_chemical_formula_sum            'F2 Hg3 S2'
_chemical_name_systematic        'Hg3 S2 F2'
_space_group_IT_number           199
_symmetry_space_group_name_Hall  'I 2b 2c 3'
_symmetry_space_group_name_H-M   'I 21 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.14
_cell_length_b                   8.14
_cell_length_c                   8.14
_cell_volume                     539.353
_citation_journal_id_ASTM        NATWAY
_cod_data_source_file            Puff_NATWAY_1968_373.cif
_cod_data_source_block           F2Hg3S2
_cod_original_cell_volume        539.3532
_cod_database_code               1528807
Order and disorder among the layered double hydroxides: A combined Rietveld and DIFFaX approach
Radha, A.V.; Kamath, P.V.; Shivakumara, C.; Acta Crystallographica B (39,1983-) 63 (2007) 243–250; doi:

data_2106582
_publ_section_title
;
 Order and disorder among the layered double hydroxides: A combined
 Rietveld and DIFFaX approach
;
_journal_name_full               'Acta Crystallographica B (39,1983-)'
_journal_page_first              243
_journal_page_last               250
_journal_volume                  63
_journal_year                    2007
_chemical_formula_sum            'C0.5 H9 Al Co2 O9'
_chemical_name_systematic        '(Co4 Al2 (O H)12 C O3 (H2 O)3)0.5'
_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            1
_cell_length_a                   3.066045
_cell_length_b                   3.066045
_cell_length_c                   22.59311
_cell_volume                     183.935
_citation_journal_id_ASTM        ASBSDK
_cod_data_source_file            Radha_ASBSDK_2007_1288.cif
_cod_data_source_block           C0.5H9Al1Co2O9
_cod_original_cell_volume        183.9347
_cod_original_formula_sum        'C0.5 H9 Al1 Co2 O9'
_cod_database_code               2106582