LMucko/crystallography-open-database huggingface dataset:
Behavior of Mn(3+) ions in four-layered hexagonal (Sr(1-x-y) La(x) Ba(y)) Mn O3
Taguchi, H.; Hirata, K.; Hirota, K.; Kato, M.; Solid State Sciences 11 (2009) 491–495; doi:

data_1528907
_publ_section_title
;
 Behavior of Mn(3+) ions in four-layered hexagonal (Sr(1-x-y) La(x) Ba(y))
 Mn O3
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              491
_journal_page_last               495
_journal_volume                  11
_journal_year                    2009
_chemical_formula_sum            'Ba0.2 La0.02 Mn O3 Sr0.78'
_chemical_name_systematic        '(Sr0.78 Ba0.2 La0.02) Mn O3'
_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            4
_cell_length_a                   5.4962
_cell_length_b                   5.4962
_cell_length_c                   9.1172
_cell_volume                     238.516
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Taguchi_SSSCFJ_2009_1680.cif
_cod_data_source_block           Ba0.2La0.02Mn1O3Sr0.78
_cod_original_cell_volume        238.5158
_cod_original_formula_sum        'Ba0.2 La0.02 Mn1 O3 Sr0.78'
_cod_database_code               1528907
Behavior of Mn(3+) ions in four-layered hexagonal (Sr(1-x-y) La(x) Ba(y)) Mn O3
Taguchi, H.; Hirata, K.; Kato, M.; Hirota, K.; Solid State Sciences 11 (2009) 491–495; doi:

data_1528908
_publ_section_title
;
 Behavior of Mn(3+) ions in four-layered hexagonal (Sr(1-x-y) La(x) Ba(y))
 Mn O3
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              491
_journal_page_last               495
_journal_volume                  11
_journal_year                    2009
_chemical_formula_sum            'Ba0.3 La0.04 Mn O3 Sr0.66'
_chemical_name_systematic        '(Sr0.66 Ba0.3 La0.04) Mn O3'
_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            4
_cell_length_a                   5.5122
_cell_length_b                   5.5122
_cell_length_c                   9.1263
_cell_volume                     240.146
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Taguchi_SSSCFJ_2009_1681.cif
_cod_data_source_block           Ba0.3La0.04Mn1O3Sr0.66
_cod_original_formula_sum        'Ba0.3 La0.04 Mn1 O3 Sr0.66'
_cod_database_code               1528908
Behavior of Mn(3+) ions in four-layered hexagonal (Sr(1-x-y) La(x) Ba(y)) Mn O3
Taguchi, H.; Hirata, K.; Kato, M.; Hirota, K.; Solid State Sciences 11 (2009) 491–495; doi:

data_1528909
_publ_section_title
;
 Behavior of Mn(3+) ions in four-layered hexagonal (Sr(1-x-y) La(x) Ba(y))
 Mn O3
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              491
_journal_page_last               495
_journal_volume                  11
_journal_year                    2009
_chemical_formula_sum            'Ba0.4 La0.02 Mn O3 Sr0.58'
_chemical_name_systematic        '(Sr0.58 Ba0.4 La0.02) Mn O3'
_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            4
_cell_length_a                   5.5342
_cell_length_b                   5.5342
_cell_length_c                   9.1341
_cell_volume                     242.274
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Taguchi_SSSCFJ_2009_1682.cif
_cod_data_source_block           Ba0.4La0.02Mn1O3Sr0.58
_cod_original_cell_volume        242.2736
_cod_original_formula_sum        'Ba0.4 La0.02 Mn1 O3 Sr0.58'
_cod_database_code               1528909
Potassium barium hexanitrocuprate(II) at 295 K
Takagi, S.; Joesten, M.D.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 596–598; doi:

data_2106599
_publ_section_title
;
 Potassium barium hexanitrocuprate(II) at 295 K
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              596
_journal_page_last               598
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Ba Cu K2 N6 O12'
_chemical_name_systematic        'K2 Ba (Cu (N O2)6)'
_space_group_IT_number           69
_symmetry_space_group_name_Hall  '-F 2 2'
_symmetry_space_group_name_H-M   'F m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.219
_cell_length_b                   10.728
_cell_length_c                   10.685
_cell_volume                     1286.019
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Takagi_ACBCAR_1975_1914.cif
_cod_data_source_block           Ba1Cu1K2N6O12
_cod_original_formula_sum        'Ba1 Cu1 K2 N6 O12'
_cod_database_code               2106599
Potassium strontium hexanitrocuprate(II) and potassium strontium hexanitronickelate(II)
Takagi, S.; Joesten, M.D.; Lenhert, P.G.; Acta Crystallographica B (24,1968-38,1982) 32 (1976) 2524–2526; doi:

data_2106600
_publ_section_title
;
 Potassium strontium hexanitrocuprate(II) and potassium strontium
 hexanitronickelate(II)
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2524
_journal_page_last               2526
_journal_volume                  32
_journal_year                    1976
_chemical_formula_sum            'Cu K2 N6 O12 Sr'
_chemical_name_systematic        'K2 Sr (Cu (N O2)6)'
_space_group_IT_number           69
_symmetry_space_group_name_Hall  '-F 2 2'
_symmetry_space_group_name_H-M   'F m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.4301
_cell_length_b                   10.4621
_cell_length_c                   10.9368
_cell_volume                     1193.432
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Takagi_ACBCAR_1976_1771.cif
_cod_data_source_block           Cu1K2N6O12Sr1
_cod_original_formula_sum        'Cu1 K2 N6 O12 Sr1'
_cod_database_code               2106600
Potassium strontium hexanitrocuprate(II) and potassium strontium hexanitronickelate(II)
Takagi, S.; Joesten, M.D.; Lenhert, P.G.; Acta Crystallographica B (24,1968-38,1982) 32 (1976) 2524–2526; doi:

data_2106601
_publ_section_title
;
 Potassium strontium hexanitrocuprate(II) and potassium strontium
 hexanitronickelate(II)
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2524
_journal_page_last               2526
_journal_volume                  32
_journal_year                    1976
_chemical_formula_sum            'K2 N6 Ni O12 Sr'
_chemical_name_systematic        'K2 Sr (Ni (N O2)6)'
_space_group_IT_number           202
_symmetry_space_group_name_Hall  '-F 2 2 3'
_symmetry_space_group_name_H-M   'F m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.5063
_cell_length_b                   10.5063
_cell_length_c                   10.5063
_cell_volume                     1159.710
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Takagi_ACBCAR_1976_1772.cif
_cod_data_source_block           K2N6Ni1O12Sr1
_cod_original_cell_volume        1159.71
_cod_original_formula_sum        'K2 N6 Ni1 O12 Sr1'
_cod_database_code               2106601
The Structure of Diammonium Tricalcium Bis(Pyrophosphate) Hexahydrate
Takagi, S.; Mathew, M.; Brown, W.E.; Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2526–2529; doi:

data_2106602
_publ_section_title
;
 The Structure of Diammonium Tricalcium Bis(Pyrophosphate) Hexahydrate
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2526
_journal_page_last               2529
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'Ca3 H20 N2 O20 P4'
_chemical_name_systematic        '(N H4)2 Ca3 (P2 O7)2 (H2 O)6'
_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                 92.44
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.674
_cell_length_b                   11.455
_cell_length_c                   11.014
_cell_volume                     967.315
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Takagi_ACBCAR_1980_68.cif
_cod_data_source_block           H20Ca3N2O20P4
_cod_original_cell_volume        967.3152
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'H20 Ca3 N2 O20 P4'
_cod_database_code               2106602
Single crystal synthesis and structure refinement of the Li Co O2 - Li Al O2 solid solution compounds: Li Al0.32 Co0.68 O2 and Li Al0.71 Co0.29 O2
Takahashi, Y.; Akimoto, J.; Kijima, N.; Journal of Solid State Chemistry 178 (2005) 3667–3671; doi:

data_1528910
_publ_section_title
;
 Single crystal synthesis and structure refinement of the Li Co O2 - Li Al
 O2 solid solution compounds: Li Al0.32 Co0.68 O2 and Li Al0.71 Co0.29 O2
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              3667
_journal_page_last               3671
_journal_volume                  178
_journal_year                    2005
_chemical_formula_sum            'Al0.32 Co0.68 Li O2'
_chemical_name_systematic        'Li Al0.32 Co0.68 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                   2.8056
_cell_length_b                   2.8056
_cell_length_c                   14.1079
_cell_volume                     96.171
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Takahashi_JSSCBI_2005_709.cif
_cod_data_source_block           Al0.32Co0.68Li1O2
_cod_original_cell_volume        96.17107
_cod_original_formula_sum        'Al0.32 Co0.68 Li1 O2'
_cod_database_code               1528910
Single crystal synthesis and structure refinement of the Li Co O2 - Li Al O2 solid solution compounds: Li Al0.32 Co0.68 O2 and Li Al0.71 Co0.29 O2
Takahashi, Y.; Kijima, N.; Akimoto, J.; Journal of Solid State Chemistry 178 (2005) 3667–3671; doi:

data_1528911
_publ_section_title
;
 Single crystal synthesis and structure refinement of the Li Co O2 - Li Al
 O2 solid solution compounds: Li Al0.32 Co0.68 O2 and Li Al0.71 Co0.29 O2
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              3667
_journal_page_last               3671
_journal_volume                  178
_journal_year                    2005
_chemical_formula_sum            'Al0.71 Co0.29 Li O2'
_chemical_name_systematic        'Li Al0.71 Co0.29 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                   2.8023
_cell_length_b                   2.8023
_cell_length_c                   14.184
_cell_volume                     96.463
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Takahashi_JSSCBI_2005_710.cif
_cod_data_source_block           Al0.71Co0.29Li1O2
_cod_original_cell_volume        96.46252
_cod_original_formula_sum        'Al0.71 Co0.29 Li1 O2'
_cod_database_code               1528911
Structure and electron density analysis of electrochemically and chemically delithiated Li Co O2 single crystals
Takahashi, Y.; Kijima, N.; Dokko, K.; Nishizawa, M.; Akimoto, J.; Uchida, I.; Journal of Solid State Chemistry 180 (2007) 313–321; doi:

data_1528912
_publ_section_title
;
 Structure and electron density analysis of electrochemically and
 chemically delithiated Li Co O2 single crystals
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              313
_journal_page_last               321
_journal_volume                  180
_journal_year                    2007
_chemical_formula_sum            'Co Li0.68 O2'
_chemical_name_systematic        'Li0.68 Co 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                   2.8107
_cell_length_b                   2.8107
_cell_length_c                   14.2235
_cell_volume                     97.312
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Takahashi_JSSCBI_2007_1238.cif
_cod_data_source_block           Co1Li0.68O2
_cod_original_cell_volume        97.31193
_cod_original_formula_sum        'Co1 Li0.68 O2'
_cod_database_code               1528912
Structure and electron density analysis of electrochemically and chemically delithiated Li Co O2 single crystals
Takahashi, Y.; Uchida, I.; Kijima, N.; Nishizawa, M.; Dokko, K.; Akimoto, J.; Journal of Solid State Chemistry 180 (2007) 313–321; doi:

data_1528913
_publ_section_title
;
 Structure and electron density analysis of electrochemically and
 chemically delithiated Li Co O2 single crystals
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              313
_journal_page_last               321
_journal_volume                  180
_journal_year                    2007
_chemical_formula_sum            'Co Li0.48 O2'
_chemical_name_systematic        'Li0.48 Co 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                   2.809
_cell_length_b                   2.809
_cell_length_c                   14.389
_cell_volume                     98.325
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Takahashi_JSSCBI_2007_1239.cif
_cod_data_source_block           Co1Li0.48O2
_cod_original_cell_volume        98.32517
_cod_original_formula_sum        'Co1 Li0.48 O2'
_cod_database_code               1528913
Structure and electron density analysis of electrochemically and chemically delithiated Li Co O2 single crystals
Takahashi, Y.; Kijima, N.; Nishizawa, M.; Dokko, K.; Uchida, I.; Akimoto, J.; Journal of Solid State Chemistry 180 (2007) 313–321; doi:

data_1528914
_publ_section_title
;
 Structure and electron density analysis of electrochemically and
 chemically delithiated Li Co O2 single crystals
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              313
_journal_page_last               321
_journal_volume                  180
_journal_year                    2007
_chemical_formula_sum            'Co Li0.35 O2'
_chemical_name_systematic        'Li0.35 Co 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                   2.807
_cell_length_b                   2.807
_cell_length_c                   14.4359
_cell_volume                     98.505
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Takahashi_JSSCBI_2007_1240.cif
_cod_data_source_block           Co1Li0.35O2
_cod_original_cell_volume        98.50523
_cod_original_formula_sum        'Co1 Li0.35 O2'
_cod_database_code               1528914
Crystal structure of Ba Ni O3
Takeda, Y.; Kanamaru, F.; Shimada, M.; Koizumi, M.; Acta Crystallographica B (24,1968-38,1982) 32 (1976) 2464–2466; doi:

data_2106603
_publ_section_title
;
 Crystal structure of Ba Ni O3
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2464
_journal_page_last               2466
_journal_volume                  32
_journal_year                    1976
_chemical_formula_sum            'Ba Ni O3'
_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                   5.629
_cell_length_b                   5.629
_cell_length_c                   4.811
_cell_volume                     132.017
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Takeda_ACBCAR_1976_1769.cif
_cod_data_source_block           Ba1Ni1O3
_cod_original_cell_volume        132.0166
_cod_original_formula_sum        'Ba1 Ni1 O3'
_cod_database_code               2106603
The derivate structure of silicate garnets in Grandite
Takeuchi, Y.; Umizu, S.; Haga, N.; Sato, G.; Zeitschrift fuer Kristallographie (149,1979-) 158 (1982) 53–99; doi:

data_8103722
_publ_section_title
;
 The derivate structure of silicate garnets in Grandite
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              53
_journal_page_last               99
_journal_volume                  158
_journal_year                    1982
_chemical_formula_sum            'Al1.6 Ca3 Fe0.4 O12 Si3'
_chemical_name_systematic        'Ca3 Al1.6 Fe.4 Si3 O12'
_space_group_IT_number           230
_symmetry_space_group_name_Hall  '-I 4bd 2c 3'
_symmetry_space_group_name_H-M   'I a -3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   11.872
_cell_length_b                   11.872
_cell_length_c                   11.872
_cell_volume                     1673.292
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Takeuchi_ZEKRDZ_1982_466.cif
_cod_data_source_block           Al1.6Ca3Fe0.4O12Si3
_cod_database_code               8103722
The derivate structure of silicate garnets in grandite
Takeuchi, Y.; Umizu, S.; Haga, N.; Sato, G.; Zeitschrift fuer Kristallographie (149,1979-) 158 (1982) 53–99; doi:

data_8103723
_publ_section_title
;
 The derivate structure of silicate garnets in grandite
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              53
_journal_page_last               99
_journal_volume                  158
_journal_year                    1982
_chemical_formula_sum            'Al1.3325 Ca3 Fe0.6675 O12 Si3'
_chemical_name_systematic        'Ca3 (Al1.3325 Fe.6675) Si3 O12'
_space_group_IT_number           2
_symmetry_space_group_name_Hall
'-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)'
_symmetry_space_group_name_H-M   'I -1'
_cell_angle_alpha                90.03
_cell_angle_beta                 90.12
_cell_angle_gamma                89.98
_cell_formula_units_Z            8
_cell_length_a                   11.9197
_cell_length_b                   11.9225
_cell_length_c                   11.9199
_cell_volume                     1693.964
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Takeuchi_ZEKRDZ_1982_467.cif
_cod_data_source_block           Al1.3325Ca3Fe0.6675O12Si3
_cod_original_sg_symbol_Hall
;
-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)
;
_cod_original_sg_symbol_H-M      'P -1 (b+c,a+c,a+b)'
_cod_database_code               8103723
Crystal structure of monoclinic tungsten oxide at room temperature
Tanisaki, S.; Journal of the Physical Society of Japan 15 (1960) 573–580; doi:

data_1528915
_publ_section_title
;
 Crystal structure of monoclinic tungsten oxide at room temperature
;
_journal_name_full               'Journal of the Physical Society of Japan'
_journal_page_first              573
_journal_page_last               580
_journal_volume                  15
_journal_year                    1960
_chemical_formula_sum            'O3 W'
_chemical_name_systematic        'W O3'
_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                 90.9
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.3
_cell_length_b                   7.53
_cell_length_c                   7.68
_cell_volume                     422.110
_citation_journal_id_ASTM        JUPSAU
_cod_data_source_file            Tanisaki_JUPSAU_1960_408.cif
_cod_data_source_block           O3W1
_cod_original_cell_volume        422.1099
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'O3 W1'
_cod_database_code               1528915
Novel cation [N (S O2 N Me3)2]+ and its synthesis and crystal structure. Dichloride of imido-bis(sulfuric) acid H N (S O2 Cl)2. Part 1. Crystal structures of K N (S O2 Cl)2.(1/2) C H3 C N, K N (S O2 Cl)2.(1/6)C H2 Cl2, and [P Cl4] [N (S O2 Cl)2]
Taraba, J.; Zak, Z.; Inorganic Chemistry 45 (2006) 3695–3700; doi:

data_4343921
_publ_section_title
;
 Novel cation [N (S O2 N Me3)2]+ and its synthesis and crystal structure.
 Dichloride of imido-bis(sulfuric) acid H N (S O2 Cl)2. Part 1. Crystal
 structures of K N (S O2 Cl)2.(1/2) C H3 C N, K N (S O2 Cl)2.(1/6)C H2
 Cl2, and [P Cl4] [N (S O2 Cl)2]
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3695
_journal_page_last               3700
_journal_volume                  45
_journal_year                    2006
_chemical_formula_sum            'Cl2 H N O4 S2'
_chemical_name_systematic        'H N (S O2 Cl)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                 109.73
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.677
_cell_length_b                   9.946
_cell_length_c                   9.233
_cell_volume                     663.603
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Taraba_INOCAJ_2006_773.cif
_cod_data_source_block           H1Cl2N1O4S2
_cod_original_cell_volume        663.6026
_cod_original_formula_sum        'H1 Cl2 N1 O4 S2'
_cod_database_code               4343921