LMucko/crystallography-open-database huggingface dataset:
Komplexcarbide und -nitride mit aufgefuelltem U3 Si - Typ
Boller, H.; Monatshefte fuer Chemie (-108,1977) 99 (1968) 2444–2449; doi:

data_1534294
_publ_section_title
;
 Komplexcarbide und -nitride mit aufgefuelltem U3 Si - Typ
;
_journal_name_full               'Monatshefte fuer Chemie (-108,1977)'
_journal_page_first              2444
_journal_page_last               2449
_journal_volume                  99
_journal_year                    1968
_chemical_formula_sum            'Ge Mn3 N0.75'
_chemical_name_systematic        'Mn3 Ge N0.75'
_space_group_IT_number           140
_symmetry_space_group_name_Hall  '-I 4 2c'
_symmetry_space_group_name_H-M   'I 4/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.424
_cell_length_b                   5.424
_cell_length_c                   8.07
_cell_volume                     237.418
_citation_journal_id_ASTM        MOCHAP
_cod_data_source_file            Boller_MOCHAP_1968_969.cif
_cod_data_source_block           Ge1Mn3N0.75
_cod_original_cell_volume        237.4176
_cod_original_formula_sum        'Ge1 Mn3 N0.75'
_cod_database_code               1534294
Komplexcarbide und -nitride mit aufgefuelltem U3 Si - Typ
Boller, H.; Monatshefte fuer Chemie (-108,1977) 99 (1968) 2444–2449; doi:

data_1534295
_publ_section_title
;
 Komplexcarbide und -nitride mit aufgefuelltem U3 Si - Typ
;
_journal_name_full               'Monatshefte fuer Chemie (-108,1977)'
_journal_page_first              2444
_journal_page_last               2449
_journal_volume                  99
_journal_year                    1968
_chemical_formula_sum            'Fe3 Ge N0.51'
_space_group_IT_number           140
_symmetry_space_group_name_Hall  '-I 4 2c'
_symmetry_space_group_name_H-M   'I 4/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.231
_cell_length_b                   5.231
_cell_length_c                   7.658
_cell_volume                     209.549
_citation_journal_id_ASTM        MOCHAP
_cod_data_source_file            Boller_MOCHAP_1968_970.cif
_cod_data_source_block           Fe3Ge1N0.51
_cod_original_cell_volume        209.5486
_cod_original_formula_sum        'Fe3 Ge1 N0.51'
_cod_database_code               1534295
Bie Kristallstruktur von Cr3 Ge N
Boller, H.; Monatshefte fuer Chemie (-108,1977) 100 (1969) 1471–1476; doi:

data_1534296
_publ_section_title
;
 Bie Kristallstruktur von Cr3 Ge N
;
_journal_name_full               'Monatshefte fuer Chemie (-108,1977)'
_journal_page_first              1471
_journal_page_last               1476
_journal_volume                  100
_journal_year                    1969
_chemical_formula_sum            'Cr3 Ge N'
_space_group_IT_number           113
_symmetry_space_group_name_Hall  'P -4 2ab'
_symmetry_space_group_name_H-M   'P -4 21 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.375
_cell_length_b                   5.375
_cell_length_c                   4.012
_cell_volume                     115.909
_citation_journal_id_ASTM        MOCHAP
_cod_data_source_file            Boller_MOCHAP_1969_950.cif
_cod_data_source_block           Cr3Ge1N1
_cod_original_cell_volume        115.9092
_cod_original_formula_sum        'Cr3 Ge1 N1'
_cod_database_code               1534296
Twin orthorhombic structure of hauyne from Sakrogano (Italy)
Bolotina, N.B.; Rastsvetaeva, R.K.; Sapozhnikov, A.N.; Kashaev, A.A.; Kristallografiya 48 (2003) 981–985; doi:

data_1534297
_publ_section_title
;
 Twin orthorhombic structure of hauyne from Sakrogano (Italy)
;
_journal_name_full               Kristallografiya
_journal_page_first              981
_journal_page_last               985
_journal_volume                  48
_journal_year                    2003
_chemical_formula_sum            'Al6 Ca2.4 K1.1 Na4.5 O32 S2 Si6'
_chemical_name_systematic        '(Na4.5 K1.1 Ca2.4) (Si6 Al6 O24) (S O4)2'
_space_group_IT_number           32
_symmetry_space_group_name_Hall  'P 2 -2ab'
_symmetry_space_group_name_H-M   'P b a 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.872
_cell_length_b                   12.872
_cell_length_c                   9.102
_cell_volume                     1508.096
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Bolotina_KRISAJ_2003_476.cif
_cod_data_source_block           Al6Ca2.4K1.1Na4.5O32S2Si6
_cod_database_code               1534297
The crystal and molecular structure of ammonium tetrachloro aurate(III) 2/3 hydrate
Bonamico, M.; Dessy, G.; Furlani, C.; Capece, F.M.; Acta Crystallographica B (24,1968-38,1982) 29 (1973) 1737–1739; doi:

data_2106844
_publ_section_title
;
 The crystal and molecular structure of ammonium tetrachloro aurate(III)
 2/3 hydrate
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1737
_journal_page_last               1739
_journal_volume                  29
_journal_year                    1973
_chemical_formula_sum            'Au Cl4 H5.3334 N O0.6667'
_chemical_name_systematic        'N H4 Au Cl4 (H2 O).6667'
_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                 102.58
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   14.054
_cell_length_b                   11.519
_cell_length_c                   14.496
_cell_volume                     2290.391
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Bonamico_ACBCAR_1973_1077.cif
_cod_data_source_block           H5.3334Au1Cl4N1O0.6667
_cod_original_formula_sum        'H5.3334 Au1 Cl4 N1 O0.6667'
_cod_database_code               2106844
Structures and magnetic properties of some metal(I) chromium(III) sulfides and selenides
Bongers, P.F.; van Bruggen, C.F.; Koopstra, J.; Omloo, W.P.F.A.M.; Wiegers, G.A.; Jellinek, F.; Journal of Physics and Chemistry of Solids 29 (1968) 977–984; doi:

data_1534298
_publ_section_title
;
 Structures and magnetic properties of some metal(I) chromium(III)
 sulfides and selenides
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              977
_journal_page_last               984
_journal_volume                  29
_journal_year                    1968
_chemical_formula_sum            'Ag Cr S2'
_space_group_IT_number           160
_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                   3.496
_cell_length_b                   3.496
_cell_length_c                   20.53
_cell_volume                     217.301
_citation_journal_id_ASTM        JPCSAW
_cod_data_source_file            Bongers_JPCSAW_1968_282.cif
_cod_data_source_block           Ag1Cr1S2
_cod_original_cell_volume        217.3014
_cod_original_formula_sum        'Ag1 Cr1 S2'
_cod_database_code               1534298
Structures and Magnetic Properties of Some Metal(I) Chromium(III) Sulfides and Selenides
Bongers, P.F.; Jellinek, F.; van Bruggen, C.F.; Koopstra, J.; Omloo, W.P.F.A.M.; Wiegers, G.A.; Journal of Physics and Chemistry of Solids 29 (1968) 977–984; doi:

data_1534299
_publ_section_title
;
 Structures and Magnetic Properties of Some Metal(I) Chromium(III)
 Sulfides and Selenides
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              977
_journal_page_last               984
_journal_volume                  29
_journal_year                    1968
_chemical_formula_sum            'Cr Cu Se2'
_chemical_name_systematic        'Cu Cr Se2'
_space_group_IT_number           160
_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                   3.676
_cell_length_b                   3.676
_cell_length_c                   19.37
_cell_volume                     226.679
_citation_journal_id_ASTM        JPCSAW
_cod_data_source_file            Bongers_JPCSAW_1968_283.cif
_cod_data_source_block           Cr1Cu1Se2
_cod_original_formula_sum        'Cr1 Cu1 Se2'
_cod_database_code               1534299
Structures and Magnetic Properties of Some Metal(I) Chromium(III) Sulfides and Selenides
Bongers, P.F.; Omloo, W.P.F.A.M.; van Bruggen, C.F.; Koopstra, J.; Wiegers, G.A.; Jellinek, F.; Journal of Physics and Chemistry of Solids 29 (1968) 977–984; doi:

data_1534300
_publ_section_title
;
 Structures and Magnetic Properties of Some Metal(I) Chromium(III)
 Sulfides and Selenides
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              977
_journal_page_last               984
_journal_volume                  29
_journal_year                    1968
_chemical_formula_sum            'Ag Cr Se2'
_space_group_IT_number           160
_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                   3.682
_cell_length_b                   3.682
_cell_length_c                   21.23
_cell_volume                     249.257
_citation_journal_id_ASTM        JPCSAW
_cod_data_source_file            Bongers_JPCSAW_1968_284.cif
_cod_data_source_block           Ag1Cr1Se2
_cod_original_cell_volume        249.2575
_cod_original_formula_sum        'Ag1 Cr1 Se2'
_cod_database_code               1534300
The Crystal Structure of I2 Cl6 (I Cl3)
Boswijk, K.H.; Wiebenga, E.H.; Acta Crystallographica (1,1948-23,1967) 7 (1954) 417–423; doi:

data_2310749
_publ_section_title
;
 The Crystal Structure of I2 Cl6 (I Cl3)
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              417
_journal_page_last               423
_journal_volume                  7
_journal_year                    1954
_chemical_formula_sum            'Cl6 I2'
_chemical_name_systematic        '(I Cl3)2'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                130.83
_cell_angle_beta                 80.83
_cell_angle_gamma                108.5
_cell_formula_units_Z            1
_cell_length_a                   5.71
_cell_length_b                   10.88
_cell_length_c                   5.48
_cell_volume                     243.737
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Boswijk_ACCRA9_1954_210.cif
_cod_data_source_block           Cl6I2
_cod_original_cell_volume        243.7368
_cod_database_code               2310749
The crystal structure of I Cl-alpha
Boswijk, K.H.; van der Heide, J.; Vos, A.; Wiebenga, E.H.; Acta Crystallographica (1,1948-23,1967) 9 (1956) 274–277; doi:

data_2310750
_publ_section_title
;
 The crystal structure of I Cl-alpha
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              274
_journal_page_last               277
_journal_volume                  9
_journal_year                    1956
_chemical_formula_sum            'Cl I'
_chemical_name_systematic        'I Cl'
_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                 119.5
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.6
_cell_length_b                   4.38
_cell_length_c                   11.9
_cell_volume                     571.595
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Boswijk_ACCRA9_1956_1035.cif
_cod_data_source_block           Cl1I1
_cod_original_formula_sum        'Cl1 I1'
_cod_database_code               2310750
Preparation et etude d'un oxyphosphate Fe4 (P O4)2 O
Bouchdoug, M.; Courtois, A.; Gerardin, R.; Steinmetz, J.; Gleitzer, C.; Journal of Solid State Chemistry 42 (1982) 149–157; doi:

data_1534301
_publ_section_title
;
 Preparation et etude d'un oxyphosphate Fe4 (P O4)2 O
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              149
_journal_page_last               157
_journal_volume                  42
_journal_year                    1982
_chemical_formula_sum            'Fe4 O9 P2'
_chemical_name_systematic        'Fe4 (P O4)2 O'
_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                 103.95
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.564
_cell_length_b                   11.271
_cell_length_c                   9.383
_cell_volume                     673.707
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Bouchdoug_JSSCBI_1982_1732.cif
_cod_data_source_block           Fe4O9P2
_cod_original_cell_volume        673.7072
_cod_database_code               1534301
The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n
Boudreau, R.A.; Haendler, H.M.; Journal of Solid State Chemistry 36 (1981) 289–296; doi:

data_1534302
_publ_section_title
;
 The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              289
_journal_page_last               296
_journal_volume                  36
_journal_year                    1981
_chemical_formula_sum            'S6.9 Se1.1'
_chemical_name_systematic        'Se1.1 S6.9'
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2yc'
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 123.9
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.34
_cell_length_b                   13.11
_cell_length_c                   9.3
_cell_volume                     843.988
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Boudreau_JSSCBI_1981_1403.cif
_cod_data_source_block           S6.9Se1.1
_cod_original_cell_volume        843.9879
_cod_database_code               1534302
The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n
Boudreau, R.A.; Haendler, H.M.; Journal of Solid State Chemistry 36 (1981) 289–296; doi:

data_1534303
_publ_section_title
;
 The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              289
_journal_page_last               296
_journal_volume                  36
_journal_year                    1981
_chemical_formula_sum            'S4.35 Se3.55'
_chemical_name_systematic        'Se3.7 S4.3'
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2yc'
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 124.5
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.4
_cell_length_b                   13.26
_cell_length_c                   9.37
_cell_volume                     860.114
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Boudreau_JSSCBI_1981_1404.cif
_cod_data_source_block           S4.35Se3.55
_cod_original_cell_volume        860.1141
_cod_database_code               1534303
Structure cristalline de l'hypovanadate Ca V4 O9
Bouloux, J.C.; Galy, J.; Acta Crystallographica B (24,1968-38,1982) 29 (1973) 1335–1338; doi:

data_2106845
_publ_section_title
;
 Structure cristalline de l'hypovanadate Ca V4 O9
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1335
_journal_page_last               1338
_journal_volume                  29
_journal_year                    1973
_chemical_formula_sum            'Ca O9 V4'
_chemical_name_systematic        'Ca (V4 O9)'
_space_group_IT_number           85
_symmetry_space_group_name_Hall  '-P 4a'
_symmetry_space_group_name_H-M   'P 4/n :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.333
_cell_length_b                   8.333
_cell_length_c                   5.008
_cell_volume                     347.750
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Bouloux_ACBCAR_1973_800.cif
_cod_data_source_block           Ca1O9V4
_cod_original_cell_volume        347.75
_cod_original_formula_sum        'Ca1 O9 V4'
_cod_database_code               2106845
Zur Kenntnis von Na14 (Fe6 O16)
Brachtel, G.; Hoppe, R.; Zeitschrift fuer Anorganische und Allgemeine Chemie 446 (1978) 87–96; doi:

data_1534304
_publ_section_title
;
 Zur Kenntnis von Na14 (Fe6 O16)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              87
_journal_page_last               96
_journal_volume                  446
_journal_year                    1978
_chemical_formula_sum            'Fe6 Na14 O16'
_chemical_name_systematic        'Na14 Fe6 O16'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                109.34
_cell_angle_beta                 87.76
_cell_angle_gamma                111.36
_cell_formula_units_Z            1
_cell_length_a                   11.427
_cell_length_b                   8.271
_cell_length_c                   5.953
_cell_volume                     492.286
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Brachtel_ZAACAB_1978_269.cif
_cod_data_source_block           Fe6Na14O16
_cod_original_cell_volume        492.2856
_cod_database_code               1534304
Zur Kenntnis von Na4 Fe2 O5
Brachtel, G.; Hoppe, R.; Zeitschrift fuer Anorganische und Allgemeine Chemie 446 (1978) 97–104; doi:

data_1534305
_publ_section_title
;
 Zur Kenntnis von Na4 Fe2 O5
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              97
_journal_page_last               104
_journal_volume                  446
_journal_year                    1978
_chemical_formula_sum            'Fe2 Na4 O5'
_chemical_name_systematic        'Na4 Fe2 O5'
_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                 104.5
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.872
_cell_length_b                   5.679
_cell_length_c                   9.178
_cell_volume                     599.081
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Brachtel_ZAACAB_1978_276.cif
_cod_data_source_block           Fe2Na4O5
_cod_original_cell_volume        599.0808
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_database_code               1534305
Zur Kenntnis von Na5 Fe O4
Brachtel, G.; Hoppe, R.; Zeitschrift fuer Anorganische und Allgemeine Chemie 446 (1978) 77–86; doi:

data_1534306
_publ_section_title
;
 Zur Kenntnis von Na5 Fe O4
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              77
_journal_page_last               86
_journal_volume                  446
_journal_year                    1978
_chemical_formula_sum            'Fe Na5 O4'
_chemical_name_systematic        'Na5 (Fe O4)'
_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                   10.334
_cell_length_b                   5.974
_cell_length_c                   18.08199
_cell_volume                     1116.297
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Brachtel_ZAACAB_1978_319.cif
_cod_data_source_block           Fe1Na5O4
_cod_original_formula_sum        'Fe1 Na5 O4'
_cod_database_code               1534306
K6 Mn2 O6 und K6 F E O6 - ein Vergleich
Brachtel, G.; Hoppe, R.; Zeitschrift fuer Anorganische und Allgemeine Chemie 446 (1978) 64–76; doi:

data_1534307
_publ_section_title
;
 K6 Mn2 O6 und K6 F E O6 - ein Vergleich
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              64
_journal_page_last               76
_journal_volume                  446
_journal_year                    1978
_chemical_formula_sum            'K6 Mn2 O6'
_chemical_name_systematic        'K6 (Mn2 O6)'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2bc'
_symmetry_space_group_name_H-M   'P 1 1 21/b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                132.13
_cell_formula_units_Z            2
_cell_length_a                   8.886
_cell_length_b                   6.76
_cell_length_c                   11.394
_cell_volume                     507.590
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Brachtel_ZAACAB_1978_341.cif
_cod_data_source_block           K6Mn2O6
_cod_original_cell_volume        507.5904
_cod_original_sg_symbol_Hall     '-P 2ybc (-x,z,y)'
_cod_database_code               1534307
The crystal and molecular structure of hydrazinium tris(hydrazincarboxylato-N,O)niccolate(II) monohydrate
Braibanti, A.; Manotti Lanfredi, A.M.; Tiripicchio, A.; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 124 (1967) 335–351; doi:

data_8103828
_publ_section_title
;
 The crystal and molecular structure of hydrazinium
 tris(hydrazincarboxylato-N,O)niccolate(II) monohydrate
;
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, 
Kristallchemie (-144,1977)
;
_journal_page_first              335
_journal_page_last               351
_journal_volume                  124
_journal_year                    1967
_chemical_formula_sum            'C3 H16 N8 Ni O7'
_chemical_name_systematic        '(N2 H5) (Ni (N H2 (N H) (C O O))3) (H2 O)'
_space_group_IT_number           9
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 121.1
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.129
_cell_length_b                   10.858
_cell_length_c                   10.255
_cell_volume                     1156.431
_citation_journal_id_ASTM        ZEKGAX
_cod_data_source_file            Braibanti_ZEKGAX_1967_1767.cif
_cod_data_source_block           C3H16N8Ni1O7
_cod_original_formula_sum        'C3 H16 N8 Ni1 O7'
_cod_database_code               8103828