LMucko/crystallography-open-database huggingface dataset:
Crystal growth, structure and properties of the palladium-rich telluride Pd13 Te3
Janetzky, M.; Harbrecht, B.; Zeitschrift fuer Anorganische und Allgemeine Chemie 632 (2006) 837–844; doi:

data_1528604
_publ_section_title
;
 Crystal growth, structure and properties of the palladium-rich telluride
 Pd13 Te3
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              837
_journal_page_last               844
_journal_volume                  632
_journal_year                    2006
_chemical_formula_sum            'Pd13 Te3'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.6681
_cell_length_b                   12.6681
_cell_length_c                   12.6681
_cell_volume                     2032.986
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Janetzky_ZAACAB_2006_988.cif
_cod_data_source_block           Pd13Te3
_cod_original_sg_symbol_Hall     '-F 4vw 2vw 3 (x+1/8,y+1/8,z+1/8)'
_cod_database_code               1528604
La structure du cuivreux quadratique
Janosi, A.; Acta Crystallographica (1,1948-23,1967) 17 (1964) 311–312; doi:

data_2310609
_publ_section_title
;
 La structure du cuivreux quadratique
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              311
_journal_page_last               312
_journal_volume                  17
_journal_year                    1964
_chemical_formula_sum            'Cu2 S'
_space_group_IT_number           96
_symmetry_space_group_name_Hall  'P 4nw 2abw'
_symmetry_space_group_name_H-M   'P 43 21 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   3.9962
_cell_length_b                   3.9962
_cell_length_c                   11.287
_cell_volume                     180.249
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Janosi_ACCRA9_1964_137.cif
_cod_data_source_block           Cu2S1
_cod_original_formula_sum        'Cu2 S1'
_cod_database_code               2310609
Kristallstruktur von P4 O7
Jansen, M.; Voss, M.; Angewandte Chemie (German Edition) 93 (1981) 120–121; doi:

data_1528605
_publ_section_title
;
 Kristallstruktur von P4 O7
;
_journal_name_full               'Angewandte Chemie (German Edition)'
_journal_page_first              120
_journal_page_last               121
_journal_volume                  93
_journal_year                    1981
_chemical_formula_sum            'O7 P4'
_chemical_name_systematic        'P4 O7'
_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                 96.8
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.817
_cell_length_b                   9.954
_cell_length_c                   6.858
_cell_volume                     665.439
_citation_journal_id_ASTM        ANCEAD
_cod_data_source_file            Jansen_ANCEAD_1981_76.cif
_cod_data_source_block           O7P4
_cod_original_cell_volume        665.4388
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_database_code               1528605
Zur Kristallstruktur von Kaliumdisilicat
Jansen, M.; Zeitschrift fuer Kristallographie (149,1979-) 160 (1982) 127–133; doi:

data_8103706
_publ_section_title
;
 Zur Kristallstruktur von Kaliumdisilicat
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              127
_journal_page_last               133
_journal_volume                  160
_journal_year                    1982
_chemical_formula_sum            'K6 O7 Si2'
_chemical_name_systematic        'K6 (Si2 O7)'
_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                 125
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.458
_cell_length_b                   8.887
_cell_length_c                   10.879
_cell_volume                     511.454
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Jansen_ZEKRDZ_1982_592.cif
_cod_data_source_block           K6O7Si2
_cod_original_cell_volume        511.4542
_cod_database_code               8103706
Die Strukturverfeinerung des zweidimensional fehlgeordneten Natriummetaphosphates, Na2 H2 P4 O12
Jarchow, O.; Acta Crystallographica (1,1948-23,1967) 17 (1964) 1253–1262; doi:

data_2310610
_publ_section_title
;
 Die Strukturverfeinerung des zweidimensional fehlgeordneten
 Natriummetaphosphates, Na2 H2 P4 O12
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              1253
_journal_page_last               1262
_journal_volume                  17
_journal_year                    1964
_chemical_formula_sum            'H2 Na2 O12 P4'
_chemical_name_systematic        'Na2 H2 (P4 O12)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.37
_cell_length_b                   14.79
_cell_length_c                   7.3
_cell_volume                     1011.651
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Jarchow_ACCRA9_1964_165.cif
_cod_data_source_block           H2Na2O12P4
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_database_code               2310610
Crystal Molecular Structure of the Six-Electron-Reduced Form of Metatungstate Rb4 H8 (H2 W12 O40) (H2 O)18 Occurrence of a Metal-Metal Bonded Subcluster in a Heteropolyanion Framework
Jeannin, Y.P.; Launay, J.P.; Sedjadi, S.M.A.; Inorganic Chemistry 19 (1980) 2933–2935; doi:

data_4343863
_publ_section_title
;
 Crystal Molecular Structure of the Six-Electron-Reduced Form of
 Metatungstate Rb4 H8 (H2 W12 O40) (H2 O)18 Occurrence of a Metal-Metal
 Bonded Subcluster in a Heteropolyanion Framework
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              2933
_journal_page_last               2935
_journal_volume                  19
_journal_year                    1980
_chemical_formula_sum            'O46 Rb3.9999 W12'
_chemical_name_systematic        'Rb4 H8 (H2 W12 O40) (H2 O)18'
_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            8
_cell_length_a                   22.051
_cell_length_b                   22.051
_cell_length_c                   22.051
_cell_volume                     10722.224
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Jeannin_INOCAJ_1980_90.cif
_cod_data_source_block           O46Rb3.9999W12
_cod_original_cell_volume        10722.22
_cod_database_code               4343863
The Crystal Structure of Potassium Aminedisulphonate
Jeffrey, G. A.; Jones, D. W.; Acta Crystallographica (1,1948-23,1967) 9 (1956) 283–289; doi:10.1107/S0365110X56000796

data_2310611
_publ_section_title
;
 The Crystal Structure of Potassium Aminedisulphonate
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              283
_journal_page_last               289
_journal_paper_doi               10.1107/S0365110X56000796
_journal_volume                  9
_journal_year                    1956
_chemical_formula_sum            'H K2 N O6 S2'
_chemical_name_systematic        'K2 N H (S O3)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                 90.18
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.43
_cell_length_b                   7.458
_cell_length_c                   7.175
_cell_volume                     665.140
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Jeffrey_ACCRA9_1956_191.cif
_cod_data_source_block           H1K2N1O6S2
_cod_original_cell_volume        665.1404
_cod_original_formula_sum        'H1 K2 N1 O6 S2'
_cod_database_code               2310611
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2016-12-28
;
The structure of aluminium tetroxycarbide
Jeffrey, G.A.; Slaughter, M.; Acta Crystallographica (1,1948-23,1967) 16 (1963) 177–184; doi:

data_2310612
_publ_section_title
;
 The structure of aluminium tetroxycarbide
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              177
_journal_page_last               184
_journal_volume                  16
_journal_year                    1963
_chemical_formula_sum            'C Al4 O4'
_chemical_name_systematic        'Al4 O4 C'
_space_group_IT_number           36
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.76
_cell_length_b                   8.537
_cell_length_c                   9.121
_cell_volume                     448.508
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Jeffrey_ACCRA9_1963_1903.cif
_cod_data_source_block           C1Al4O4
_cod_original_cell_volume        448.5081
_cod_original_formula_sum        'C1 Al4 O4'
_cod_database_code               2310612
High-pressure Mn P4 , a polyphosphide with Mn-Mn pairs
Jeitschko, W.; Donohue, P.C.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 574–580; doi:

data_2106526
_publ_section_title
;
 High-pressure Mn P4 , a polyphosphide with Mn-Mn pairs
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              574
_journal_page_last               580
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Mn P4'
_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                 94.71
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   10.513
_cell_length_b                   5.0944
_cell_length_c                   21.804
_cell_volume                     1163.823
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Jeitschko_ACBCAR_1975_1913.cif
_cod_data_source_block           Mn1P4
_cod_original_formula_sum        'Mn1 P4'
_cod_database_code               2106526
Y2 Hf S5 with ordered U3 Se5 type structure and related compounds
Jeitschko, W.; Donohue, P.C.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 1890–1895; doi:

data_2106527
_publ_section_title
;
 Y2 Hf S5 with ordered U3 Se5 type structure and related compounds
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1890
_journal_page_last               1895
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Hf S5 Y2'
_chemical_name_systematic        'Y2 Hf S5'
_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                   11.4585
_cell_length_b                   7.7215
_cell_length_c                   7.2207
_cell_volume                     638.864
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Jeitschko_ACBCAR_1975_1942.cif
_cod_data_source_block           Hf1S5Y2
_cod_original_cell_volume        638.8644
_cod_original_formula_sum        'Hf1 S5 Y2'
_cod_database_code               2106527
A high-temperature X-ray study of the displacive phase transition in Mn Co Ge
Jeitschko, W.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 1187–1190; doi:

data_2106528
_publ_section_title
;
 A high-temperature X-ray study of the displacive phase transition in Mn
 Co Ge
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1187
_journal_page_last               1190
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Co0.974 Ge Mn0.997'
_chemical_name_systematic        'Mn.997 Co0.974 Ge'
_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                   5.947
_cell_length_b                   3.826
_cell_length_c                   7.051
_cell_volume                     160.433
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Jeitschko_ACBCAR_1975_1965.cif
_cod_data_source_block           Co0.974Ge1Mn0.997
_cod_original_formula_sum        'Co0.974 Ge1 Mn0.997'
_cod_database_code               2106528
A high-temperature X-ray study of the displacive phase transition in Mn Co Ge
Jeitschko, W.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 1187–1190; doi:

data_2106529
_publ_section_title
;
 A high-temperature X-ray study of the displacive phase transition in Mn
 Co Ge
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1187
_journal_page_last               1190
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Co0.974 Ge Mn0.997'
_chemical_name_systematic        'Mn0.997 Co0.974 Ge'
_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                   5.316
_cell_length_b                   4.087
_cell_length_c                   7.079
_cell_volume                     153.802
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Jeitschko_ACBCAR_1975_1966.cif
_cod_data_source_block           Co0.974Ge1Mn0.997
_cod_original_cell_volume        153.8018
_cod_original_formula_sum        'Co0.974 Ge1 Mn0.997'
_cod_database_code               2106529
Die Kristallstruktur von Mo Al B
Jeitschko, W.; Monatshefte fuer Chemie (-108,1977) 97 (1966) 1472–1476; doi:

data_1528606
_publ_section_title
;
 Die Kristallstruktur von Mo Al B
;
_journal_name_full               'Monatshefte fuer Chemie (-108,1977)'
_journal_page_first              1472
_journal_page_last               1476
_journal_volume                  97
_journal_year                    1966
_chemical_formula_sum            'Al B Mo'
_chemical_name_systematic        'Mo Al B'
_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                   3.212
_cell_length_b                   13.985
_cell_length_c                   3.102
_cell_volume                     139.341
_citation_journal_id_ASTM        MOCHAP
_cod_data_source_file            Jeitschko_MOCHAP_1966_284.cif
_cod_data_source_block           Al1B1Mo1
_cod_original_cell_volume        139.3413
_cod_original_formula_sum        'Al1 B1 Mo1'
_cod_database_code               1528606
Syntheses, structures, magnetism, and optical properties of gadolinium scandium chalcogenides
Jin Gengbang; Choi Eunsang; Albrecht-Schmitt, T.E.; Journal of Solid State Chemistry 182 (2009) 1075–1081; doi:

data_1528607
_publ_section_title
;
 Syntheses, structures, magnetism, and optical properties of gadolinium
 scandium chalcogenides
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1075
_journal_page_last               1081
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'Gd3.04 S6 Sc0.96'
_chemical_name_systematic        'Gd3.04 Sc0.96 S6'
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.5488
_cell_length_b                   16.3057
_cell_length_c                   3.8337
_cell_volume                     846.951
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            JinGengbang_JSSCBI_2009_1727.cif
_cod_data_source_block           Gd3.04S6Sc0.96
_cod_original_cell_volume        846.9513
_cod_database_code               1528607
Syntheses, structures, magnetism, and optical properties of gadolinium scandium chalcogenides
Jin Gengbang; Choi Eunsang; Albrecht-Schmitt, T.E.; Journal of Solid State Chemistry 182 (2009) 1075–1081; doi:

data_1528608
_publ_section_title
;
 Syntheses, structures, magnetism, and optical properties of gadolinium
 scandium chalcogenides
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1075
_journal_page_last               1081
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'Gd S3 Sc'
_chemical_name_systematic        'Gd Sc S3'
_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                   7.0361
_cell_length_b                   9.4574
_cell_length_c                   6.3833
_cell_volume                     424.765
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            JinGengbang_JSSCBI_2009_1728.cif
_cod_data_source_block           Gd1S3Sc1
_cod_original_cell_volume        424.7653
_cod_original_formula_sum        'Gd1 S3 Sc1'
_cod_database_code               1528608
Syntheses, structures, magnetism, and optical properties of gadolinium scandium chalcogenides
Jin Gengbang; Choi Eunsang; Albrecht-Schmitt, T.E.; Journal of Solid State Chemistry 182 (2009) 1075–1081; doi:

data_1528609
_publ_section_title
;
 Syntheses, structures, magnetism, and optical properties of gadolinium
 scandium chalcogenides
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1075
_journal_page_last               1081
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'Gd1.05 Sc0.95 Se3'
_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                   3.8922
_cell_length_b                   12.648
_cell_length_c                   9.621
_cell_volume                     473.628
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            JinGengbang_JSSCBI_2009_1729.cif
_cod_data_source_block           Gd1.05Sc0.95Se3
_cod_original_cell_volume        473.6278
_cod_database_code               1528609
The crystal structure of Hexaaquamercury(II) perchlorate, (HG (H2 O)6) (CL O4)2
Johansson, G.; Sandstroem, M.; Acta Chemica Scandinavica, Series A: (28,1974-) 32 (1978) 109–113; doi:

data_1528610
_publ_section_title
;
 The crystal structure of Hexaaquamercury(II) perchlorate, (HG (H2 O)6)
 (CL O4)2
;
_journal_name_full
'Acta Chemica Scandinavica, Series A: (28,1974-)'
_journal_page_first              109
_journal_page_last               113
_journal_volume                  32
_journal_year                    1978
_chemical_formula_sum            'Cl2 H12 Hg O14'
_chemical_name_systematic        '(Hg (H2 O)6) (Cl O4)2'
_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                   8.005
_cell_length_b                   8.005
_cell_length_c                   5.344
_cell_volume                     296.565
_citation_journal_id_ASTM        ACAPCT
_cod_data_source_file            Johansson_ACAPCT_1978_34.cif
_cod_data_source_block           H12Cl2Hg1O14
_cod_original_cell_volume        296.5649
_cod_original_formula_sum        'H12 Cl2 Hg1 O14'
_cod_database_code               1528610
Manganese(II) sulfite trihydrate
Johansson, L.G.; Lindqvist, O.; Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2739–2741; doi:

data_2106530
_publ_section_title
;
 Manganese(II) sulfite trihydrate
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2739
_journal_page_last               2741
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'H6 Mn O6 S'
_chemical_name_systematic        'Mn (S O3) (H2 O)3'
_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                 96.1
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.659
_cell_length_b                   8.92
_cell_length_c                   8.806
_cell_volume                     520.100
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Johansson_ACBCAR_1980_61.cif
_cod_data_source_block           H6Mn1O6S1
_cod_original_cell_volume        520.0996
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'H6 Mn1 O6 S1'
_cod_database_code               2106530
The structure of cesium hydrogensulfite
Johansson, L.G.; Lindqvist, O.; Vannerberg, N.G.; Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2523–2526; doi:

data_2106531
_publ_section_title
;
 The structure of cesium hydrogensulfite
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2523
_journal_page_last               2526
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'Cs H O3 S'
_chemical_name_systematic        'Cs (H S O3)'
_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                85.31
_cell_angle_beta                 85.31
_cell_angle_gamma                85.31
_cell_formula_units_Z            1
_cell_length_a                   4.6721
_cell_length_b                   4.6721
_cell_length_c                   4.6721
_cell_volume                     101.013
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Johansson_ACBCAR_1980_69.cif
_cod_data_source_block           H1Cs1O3S1
_cod_original_cell_volume        101.0134
_cod_original_sg_symbol_Hall     'R 3 -2" (-y+z,x+z,-x+y+z)'
_cod_original_formula_sum        'H1 Cs1 O3 S1'
_cod_database_code               2106531