LMucko/crystallography-open-database huggingface dataset:
Preparation and crystal structure of cesium-lanthanum nitrate Cs2: La (N O3)5 (H2 O)2:
Vigdorchik, A.G.; Malinovskii, Yu.A.; Dryuchko, A.G.; Kristallografiya 35 (1990) 1395–1398; doi:

data_1536037
_publ_section_title
;
 Preparation and crystal structure of cesium-lanthanum nitrate Cs2: La (N
 O3)5 (H2 O)2:
;
_journal_name_full               Kristallografiya
_journal_page_first              1395
_journal_page_last               1398
_journal_volume                  35
_journal_year                    1990
_chemical_formula_sum            'Cs2 H4 La N5 O17'
_chemical_name_systematic        'Cs2 (La (N O3)5 (H2 O)2)'
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-I 2ya'
_space_group_name_H-M_alt        'I 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 103.2
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.868
_cell_length_b                   9.063
_cell_length_c                   17.557
_cell_volume                     1683.616
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Vigdorchik_KRISAJ_1990_1061.cif
_cod_data_source_block           H4Cs2La1N5O17
_cod_original_formula_sum        'H4 Cs2 La1 N5 O17'
_cod_database_code               1536037
The phase diagram and tetragonal superstructures of the rare earth cobaltate phases Ln1-x Srx Co O3-d (Ln = La(3+), Pr(3+), Nd(3+), Sm(3+), Gd(3+), Y(3+), Ho(3+), Dy(3+), Er(3+), Tm(3+) and Yb(3+))
James, M.; Cassidy, D.; Goossens, D.J.; Withers, R.L.; Journal of Solid State Chemistry 177 (2004) 1886–1895; doi:

data_1536038
_publ_section_title
;
 The phase diagram and tetragonal superstructures of the rare earth
 cobaltate phases Ln1-x Srx Co O3-d (Ln = La(3+), Pr(3+), Nd(3+), Sm(3+),
 Gd(3+), Y(3+), Ho(3+), Dy(3+), Er(3+), Tm(3+) and Yb(3+))
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1886
_journal_page_last               1895
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Co Er0.1 O2.78 Sr0.9'
_chemical_name_systematic        'Er0.1 Sr0.9 (Co O2.78)'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   7.6812
_cell_length_b                   7.6812
_cell_length_c                   15.3755
_cell_volume                     907.167
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            James_JSSCBI_2004_1441.cif
_cod_data_source_block           Co1Er0.1O2.78Sr0.9
_cod_original_cell_volume        907.1673
_cod_original_formula_sum        'Co1 Er0.1 O2.78 Sr0.9'
_cod_database_code               1536038
A structural differentiation of quaternary copper argyrodites: Structure - property relations of high temperature ion conductors
Nilges, T.; Pfitzner, A.; Zeitschrift fuer Kristallographie (149,1979-) 220 (2005) 281–294; doi:

data_8104048
_publ_section_title
;
 A structural differentiation of quaternary copper argyrodites: Structure
 - property relations of high temperature ion conductors
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              281
_journal_page_last               294
_journal_volume                  220
_journal_year                    2005
_chemical_formula_sum            'As Cu6 I S5'
_chemical_name_systematic        'Cu6 As S5 I'
_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                   9.8989
_cell_length_b                   9.8989
_cell_length_c                   9.8989
_cell_volume                     969.976
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Nilges_ZEKRDZ_2005_1758.cif
_cod_data_source_block           As1Cu6I1S5
_cod_original_cell_volume        969.9756
_cod_original_formula_sum        'As1 Cu6 I1 S5'
_cod_database_code               8104048
Ordering phenomena in the Li Sb O3 type structure: The new mixed tellurates Li2 Ti Te O6 and Li2 Sn Te O6
Choisnet, J.; Rulmont, A.; Tarte, P.; Journal of Solid State Chemistry 82 (1989) 272–278; doi:

data_1536039
_publ_section_title
;
 Ordering phenomena in the Li Sb O3 type structure: The new mixed
 tellurates Li2 Ti Te O6 and Li2 Sn Te O6
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              272
_journal_page_last               278
_journal_volume                  82
_journal_year                    1989
_chemical_formula_sum            'Li2 O6 Sn Te'
_chemical_name_systematic        'Li2 Sn (Te O6)'
_space_group_IT_number           34
_symmetry_space_group_name_Hall  'P 2 -2n'
_symmetry_space_group_name_H-M   'P n n 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.192
_cell_length_b                   4.927
_cell_length_c                   8.513
_cell_volume                     217.771
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Choisnet_JSSCBI_1989_1974.cif
_cod_data_source_block           Li2O6Sn1Te1
_cod_original_cell_volume        217.7709
_cod_original_formula_sum        'Li2 O6 Sn1 Te1'
_cod_database_code               1536039
The Crystal Structure of Technetium(IV) Chloride. A New AB4 Structure
Elder, M.; Penfold, B.R.; Inorganic Chemistry 5 (1966) 1197–1200; doi:

data_4344264
_publ_section_title
;
 The Crystal Structure of Technetium(IV) Chloride. A New AB4 Structure
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1197
_journal_page_last               1200
_journal_volume                  5
_journal_year                    1966
_chemical_formula_sum            'Cl4 Tc'
_chemical_name_systematic        'Tc Cl4'
_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                   11.65
_cell_length_b                   14.06
_cell_length_c                   6.03
_cell_volume                     987.708
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Elder_INOCAJ_1966_1057.cif
_cod_data_source_block           Cl4Tc1
_cod_original_formula_sum        'Cl4 Tc1'
_cod_database_code               4344264
Crystal structure of cesium - cerium nitrate Cs2: Ce (N O3)5 (H2 O)2:
Vigdorchik, A.G.; Malinovskii, Yu.A.; Dryuchko, A.G.; Kristallografiya 35 (1990) 1399–1402; doi:

data_1536040
_publ_section_title
;
 Crystal structure of cesium - cerium nitrate Cs2: Ce (N O3)5 (H2 O)2:
;
_journal_name_full               Kristallografiya
_journal_page_first              1399
_journal_page_last               1402
_journal_volume                  35
_journal_year                    1990
_chemical_formula_sum            'Ce Cs2 H4 N5 O17'
_chemical_name_systematic        'Cs2 (Ce (N O3)5 (H2 O)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                 103.77
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.125
_cell_length_b                   8.798
_cell_length_c                   16.503
_cell_volume                     1568.852
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Vigdorchik_KRISAJ_1990_1062.cif
_cod_data_source_block           H4Ce1Cs2N5O17
_cod_original_formula_sum        'H4 Ce1 Cs2 N5 O17'
_cod_database_code               1536040
The phase diagram and tetragonal superstructures of the rare earth cobaltate phases Ln1-x Srx Co O3-d (Ln = La(3+), Pr(3+), Nd(3+), Sm(3+), Gd(3+), Y(3+), Ho(3+), Dy(3+), Er(3+), Tm(3+) and Yb(3+))
James, M.; Goossens, D.J.; Cassidy, D.; Withers, R.L.; Journal of Solid State Chemistry 177 (2004) 1886–1895; doi:

data_1536041
_publ_section_title
;
 The phase diagram and tetragonal superstructures of the rare earth
 cobaltate phases Ln1-x Srx Co O3-d (Ln = La(3+), Pr(3+), Nd(3+), Sm(3+),
 Gd(3+), Y(3+), Ho(3+), Dy(3+), Er(3+), Tm(3+) and Yb(3+))
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1886
_journal_page_last               1895
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Co O2.73 Sr0.8 Tm0.2'
_chemical_name_systematic        'Tm0.2 Sr0.8 (Co O2.73)'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   7.6643
_cell_length_b                   7.6643
_cell_length_c                   15.373
_cell_volume                     903.033
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            James_JSSCBI_2004_1442.cif
_cod_data_source_block           Co1O2.73Sr0.8Tm0.2
_cod_original_formula_sum        'Co1 O2.73 Sr0.8 Tm0.2'
_cod_database_code               1536041
A structural differentiation of quaternary copper argyrodites: Structure - property relations of high temperature ion conductors
Nilges, T.; Pfitzner, A.; Zeitschrift fuer Kristallographie (149,1979-) 220 (2005) 281–294; doi:

data_8104049
_publ_section_title
;
 A structural differentiation of quaternary copper argyrodites: Structure
 - property relations of high temperature ion conductors
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              281
_journal_page_last               294
_journal_volume                  220
_journal_year                    2005
_chemical_formula_sum            'As Br Cu6 S5'
_chemical_name_systematic        'Cu6 As S5 Br'
_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                   9.8463
_cell_length_b                   9.8463
_cell_length_c                   9.8463
_cell_volume                     954.595
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Nilges_ZEKRDZ_2005_1759.cif
_cod_data_source_block           As1Br1Cu6S5
_cod_original_cell_volume        954.5951
_cod_original_formula_sum        'As1 Br1 Cu6 S5'
_cod_database_code               8104049
Aquatrimanganese tris(selenate(IV))
Choudhury, A.; Thesis, University of Bangalore, India 2002 (2002) 1–1; doi:

data_1536042
_publ_section_title
;
 Aquatrimanganese tris(selenate(IV))
;
_journal_name_full               'Thesis, University of Bangalore, India'
_journal_page_first              1
_journal_page_last               1
_journal_volume                  2002
_journal_year                    2002
_chemical_formula_sum            'H2 Mn3 O10 Se3'
_chemical_name_systematic        '(Mn3 (H2 O)) (Se O3)3'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                65.351
_cell_angle_beta                 68.796
_cell_angle_gamma                67.738
_cell_formula_units_Z            2
_cell_length_a                   8.2714
_cell_length_b                   8.3464
_cell_length_c                   9.0073
_cell_volume                     507.475
_citation_journal_id_ASTM        UBANG2
_cod_data_source_file            Choudhury_UBANG2_2002_372.cif
_cod_data_source_block           H2Mn3O10Se3
_cod_original_cell_volume        507.4753
_cod_database_code               1536042
The Preparation and Some Properties of Magnesium Hydride
Ellinger, F.H.; Holley, C.E.jr.; McInteer, B.B.; Pavone, D.; Potter, R.M.; Zachariasen, W.H.; Staritzky, E.; Journal of the American Chemical Society 77 (1955) 2647–2648; doi:

data_4124639
_publ_section_title
;
 The Preparation and Some Properties of Magnesium Hydride
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2647
_journal_page_last               2648
_journal_volume                  77
_journal_year                    1955
_chemical_formula_sum            'H2 Mg'
_chemical_name_systematic        'Mg H2'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.5168
_cell_length_b                   4.5168
_cell_length_c                   3.0205
_cell_volume                     61.623
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Ellinger_JACSAT_1955_1460.cif
_cod_data_source_block           H2Mg1
_cod_original_cell_volume        61.62267
_cod_original_formula_sum        'H2 Mg1'
_cod_database_code               4124639
Synthesis and X-ray structural study of lithium rare-earth nitrates Li3(Ln2(NO3)9)*3H2O, where Ln=La,Nd
Vigdorchik, A.G.; Malinovskii, Yu.A.; Dryuchko, A.G.; Verin, I.A.; Kristallografiya 36 (1991) 1395–1402; doi:

data_1536043
_publ_section_title
;
 Synthesis and X-ray structural study of lithium rare-earth nitrates
 Li3(Ln2(NO3)9)*3H2O, where Ln=La,Nd
;
_journal_name_full               Kristallografiya
_journal_page_first              1395
_journal_page_last               1402
_journal_volume                  36
_journal_year                    1991
_chemical_formula_sum            'H6 La2 Li3 N9 O30'
_chemical_name_systematic        'Li3 (La2 (N O3)9) (H2 O)3'
_space_group_IT_number           198
_symmetry_space_group_name_Hall  'P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P 21 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.354
_cell_length_b                   13.354
_cell_length_c                   13.354
_cell_volume                     2381.410
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Vigdorchik_KRISAJ_1991_1211.cif
_cod_data_source_block           H6La2Li3N9O30
_cod_original_cell_volume        2381.41
_cod_database_code               1536043
The phase diagram and tetragonal superstructures of the rare earth cobaltate phases Ln1-x Srx Co O3-d (Ln = La(3+), Pr(3+), Nd(3+), Sm(3+), Gd(3+), Y(3+), Ho(3+), Dy(3+), Er(3+), Tm(3+) and Yb(3+))
James, M.; Cassidy, D.; Withers, R.L.; Goossens, D.J.; Journal of Solid State Chemistry 177 (2004) 1886–1895; doi:

data_1536044
_publ_section_title
;
 The phase diagram and tetragonal superstructures of the rare earth
 cobaltate phases Ln1-x Srx Co O3-d (Ln = La(3+), Pr(3+), Nd(3+), Sm(3+),
 Gd(3+), Y(3+), Ho(3+), Dy(3+), Er(3+), Tm(3+) and Yb(3+))
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1886
_journal_page_last               1895
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Co O2.81 Sr0.9 Tm0.1'
_chemical_name_systematic        'Tm0.1 Sr0.9 (Co O2.81)'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   7.6965
_cell_length_b                   7.6965
_cell_length_c                   15.4031
_cell_volume                     912.420
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            James_JSSCBI_2004_1443.cif
_cod_data_source_block           Co1O2.81Sr0.9Tm0.1
_cod_original_cell_volume        912.4197
_cod_original_formula_sum        'Co1 O2.81 Sr0.9 Tm0.1'
_cod_database_code               1536044
A structural differentiation of quaternary copper argyrodites: Structure - property relations of high temperature ion conductors
Nilges, T.; Pfitzner, A.; Zeitschrift fuer Kristallographie (149,1979-) 220 (2005) 281–294; doi:

data_8104050
_publ_section_title
;
 A structural differentiation of quaternary copper argyrodites: Structure
 - property relations of high temperature ion conductors
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              281
_journal_page_last               294
_journal_volume                  220
_journal_year                    2005
_chemical_formula_sum            'Cu6 I P S5'
_chemical_name_systematic        'Cu6 (P S5) I'
_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                   9.7846
_cell_length_b                   9.7846
_cell_length_c                   9.7846
_cell_volume                     936.762
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Nilges_ZEKRDZ_2005_1761.cif
_cod_data_source_block           Cu6I1P1S5
_cod_original_formula_sum        'Cu6 I1 P1 S5'
_cod_database_code               8104050
The aminodiazonium cation, H2 N3+
Christe, K.O.; Wilson, W.W.; Dixon, D.A.; Lu, R.; Khan, S.I.; Bau, R.; Metzenthin, T.; Journal of the American Chemical Society 115 (1993) 1836–1843; doi:

data_4124640
_publ_section_title
;
 The aminodiazonium cation, H2 N3+
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              1836
_journal_page_last               1843
_journal_volume                  115
_journal_year                    1993
_chemical_formula_sum            'F6 H2 N3 Sb'
_chemical_name_systematic        '((H2 N) N2) (Sb F6)'
_space_group_IT_number           26
_symmetry_space_group_name_Hall  'P 2c -2'
_symmetry_space_group_name_H-M   'P m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.794
_cell_length_b                   5.113
_cell_length_c                   9.919
_cell_volume                     293.848
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Christe_JACSAT_1993_1293.cif
_cod_data_source_block           H2F6N3Sb1
_cod_original_cell_volume        293.8476
_cod_original_formula_sum        'H2 F6 N3 Sb1'
_cod_database_code               4124640
Synthesis and X-ray structural study of lithium rare-earth nitrates Li3(Ln2(NO3)9)*3H2O, where Ln=La,Nd
Vigdorchik, A.G.; Verin, I.A.; Dryuchko, A.G.; Malinovskii, Yu.A.; Kristallografiya 36 (1991) 1395–1402; doi:

data_1536045
_publ_section_title
;
 Synthesis and X-ray structural study of lithium rare-earth nitrates
 Li3(Ln2(NO3)9)*3H2O, where Ln=La,Nd
;
_journal_name_full               Kristallografiya
_journal_page_first              1395
_journal_page_last               1402
_journal_volume                  36
_journal_year                    1991
_chemical_formula_sum            'H6 Li3 N9 Nd2 O30'
_chemical_name_systematic        'Li3 (Nd2 (N O3)9) (H2 O)3'
_space_group_IT_number           198
_symmetry_space_group_name_Hall  'P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P 21 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.22
_cell_length_b                   13.22
_cell_length_c                   13.22
_cell_volume                     2310.438
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Vigdorchik_KRISAJ_1991_1212.cif
_cod_data_source_block           H6Li3N9Nd2O30
_cod_database_code               1536045
The phase diagram and tetragonal superstructures of the rare earth cobaltate phases Ln1-x Srx Co O3-d (Ln = La(3+), Pr(3+), Nd(3+), Sm(3+), Gd(3+), Y(3+), Ho(3+), Dy(3+), Er(3+), Tm(3+) and Yb(3+))
James, M.; Cassidy, D.; Goossens, D.J.; Withers, R.L.; Journal of Solid State Chemistry 177 (2004) 1886–1895; doi:

data_1536046
_publ_section_title
;
 The phase diagram and tetragonal superstructures of the rare earth
 cobaltate phases Ln1-x Srx Co O3-d (Ln = La(3+), Pr(3+), Nd(3+), Sm(3+),
 Gd(3+), Y(3+), Ho(3+), Dy(3+), Er(3+), Tm(3+) and Yb(3+))
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1886
_journal_page_last               1895
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Co O2.78 Sr0.9 Yb0.1'
_chemical_name_systematic        'Yb0.1 Sr0.9 (Co O2.78)'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   7.6813
_cell_length_b                   7.6813
_cell_length_c                   15.3706
_cell_volume                     906.902
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            James_JSSCBI_2004_1444.cif
_cod_data_source_block           Co1O2.78Sr0.9Yb0.1
_cod_original_cell_volume        906.9019
_cod_original_formula_sum        'Co1 O2.78 Sr0.9 Yb0.1'
_cod_database_code               1536046
A structural differentiation of quaternary copper argyrodites: Structure - property relations of high temperature ion conductors
Nilges, T.; Pfitzner, A.; Zeitschrift fuer Kristallographie (149,1979-) 220 (2005) 281–294; doi:

data_8104051
_publ_section_title
;
 A structural differentiation of quaternary copper argyrodites: Structure
 - property relations of high temperature ion conductors
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              281
_journal_page_last               294
_journal_volume                  220
_journal_year                    2005
_chemical_formula_sum            'Cl Cu6.2 P S5'
_chemical_name_systematic        'Cu6.2 P S5 Cl'
_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                   9.6828
_cell_length_b                   9.6828
_cell_length_c                   9.6828
_cell_volume                     907.827
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Nilges_ZEKRDZ_2005_1762.cif
_cod_data_source_block           Cl1Cu6.2P1S5
_cod_original_cell_volume        907.8267
_cod_original_formula_sum        'Cl1 Cu6.2 P1 S5'
_cod_database_code               8104051