LMucko/crystallography-open-database huggingface dataset:
Structural and magnetic properties of Cr1-t Nit As, Mn1-t Nit As and Fe1-t Nit As
Andreassen Delphin, I.L.; Selte, K.; Andresen, A.F.; Kjekshus, A.; Acta Chemica Scandinavica, Series A: (28,1974-) 32 (1978) 179–185; doi:

data_1528311
_publ_section_title
;
 Structural and magnetic properties of Cr1-t Nit As, Mn1-t Nit As and
 Fe1-t Nit As
;
_journal_name_full
'Acta Chemica Scandinavica, Series A: (28,1974-)'
_journal_page_first              179
_journal_page_last               185
_journal_volume                  32
_journal_year                    1978
_chemical_formula_sum            'As Cr0.95 Ni0.05'
_chemical_name_systematic        'Cr0.95 Ni0.05 As'
_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                   5.6173
_cell_length_b                   3.3932
_cell_length_c                   6.199
_cell_volume                     118.157
_citation_journal_id_ASTM        ACAPCT
_cod_data_source_file            AndreassenDelphin_ACAPCT_1978_74.cif
_cod_data_source_block           As1Cr0.95Ni0.05
_cod_original_cell_volume        118.1568
_cod_original_formula_sum        'As1 Cr0.95 Ni0.05'
_cod_database_code               1528311
Structural and magnetic properties of Cr1-t Nit As, Mn1-t Nit As and Fe1-t Nit As
Andreassen Delphin, I.L.; Selte, K.; Andresen, A.F.; Kjekshus, A.; Acta Chemica Scandinavica, Series A: (28,1974-) 32 (1978) 179–185; doi:

data_1528312
_publ_section_title
;
 Structural and magnetic properties of Cr1-t Nit As, Mn1-t Nit As and
 Fe1-t Nit As
;
_journal_name_full
'Acta Chemica Scandinavica, Series A: (28,1974-)'
_journal_page_first              179
_journal_page_last               185
_journal_volume                  32
_journal_year                    1978
_chemical_formula_sum            'As Cr0.9 Ni0.1'
_chemical_name_systematic        'Cr0.9 Ni0.1 As'
_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                   5.6011
_cell_length_b                   3.3954
_cell_length_c                   6.1928
_cell_volume                     117.775
_citation_journal_id_ASTM        ACAPCT
_cod_data_source_file            AndreassenDelphin_ACAPCT_1978_92.cif
_cod_data_source_block           As1Cr0.9Ni0.1
_cod_original_cell_volume        117.7745
_cod_original_formula_sum        'As1 Cr0.9 Ni0.1'
_cod_database_code               1528312
The structure of U3 O8 determined by neutron diffraction
Andresen, A.F.; Acta Crystallographica (1,1948-23,1967) 11 (1958) 612–614; doi:

data_2310519
_publ_section_title
;
 The structure of U3 O8 determined by neutron diffraction
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              612
_journal_page_last               614
_journal_volume                  11
_journal_year                    1958
_chemical_formula_sum            'O8 U3'
_chemical_name_systematic        'U3 O8'
_space_group_IT_number           21
_symmetry_space_group_name_Hall  'C 2 2'
_symmetry_space_group_name_H-M   'C 2 2 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.704
_cell_length_b                   11.95
_cell_length_c                   4.142
_cell_volume                     331.827
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Andresen_ACCRA9_1958_268.cif
_cod_data_source_block           O8U3
_cod_original_cell_volume        331.8272
_cod_database_code               2310519
A neutron diffraction study of Fe7 Se8
Andresen, A.F.; Leciejewicz, J.; Journal de Physique (Paris) 25 (1964) 574–578; doi:

data_1528313
_publ_section_title
;
 A neutron diffraction study of Fe7 Se8
;
_journal_name_full               'Journal de Physique (Paris)'
_journal_page_first              574
_journal_page_last               578
_journal_volume                  25
_journal_year                    1964
_chemical_formula_sum            'Fe7 Se8'
_space_group_IT_number           144
_symmetry_space_group_name_Hall  'P 31'
_symmetry_space_group_name_H-M   'P 31'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   7.17
_cell_length_b                   7.17
_cell_length_c                   17.46
_cell_volume                     777.344
_citation_journal_id_ASTM        JOPQAG
_cod_data_source_file            Andresen_JOPQAG_1964_342.cif
_cod_data_source_block           Fe7Se8
_cod_original_cell_volume        777.3439
_cod_database_code               1528313
Low- and high-temperature crystal structure of Ti I3
Angelkort, J.; Schoenleber, A.; van Smaalen, S.; Journal of Solid State Chemistry 182 (2009) 525–531; doi:

data_1528314
_publ_section_title
;
 Low- and high-temperature crystal structure of Ti I3
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              525
_journal_page_last               531
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'I3 Ti'
_chemical_name_systematic        'Ti I3'
_space_group_IT_number           59
_symmetry_space_group_name_Hall  'P 2ac 2ac -1ac'
_symmetry_space_group_name_H-M   'P m n m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.2728
_cell_length_b                   7.0857
_cell_length_c                   6.4817
_cell_volume                     563.658
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Angelkort_JSSCBI_2009_1691.cif
_cod_data_source_block           I3Ti1
_cod_original_cell_volume        563.6576
_cod_original_sg_symbol_Hall     '-P 2ab 2a (y-1/4,z,x-1/4)'
_cod_original_formula_sum        'I3 Ti1'
_cod_database_code               1528314
Low- and high-temperature crystal structure of Ti I3
Angelkort, J.; Schoenleber, A.; van Smaalen, S.; Journal of Solid State Chemistry 182 (2009) 525–531; doi:

data_1528315
_publ_section_title
;
 Low- and high-temperature crystal structure of Ti I3
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              525
_journal_page_last               531
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'I3 Ti'
_chemical_name_systematic        'Ti I3'
_space_group_IT_number           193
_symmetry_space_group_name_Hall  '-P 6c 2'
_symmetry_space_group_name_H-M   'P 63/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   7.1416
_cell_length_b                   7.1416
_cell_length_c                   6.5102
_cell_volume                     287.552
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Angelkort_JSSCBI_2009_1693.cif
_cod_data_source_block           I3Ti1
_cod_original_cell_volume        287.5518
_cod_original_formula_sum        'I3 Ti1'
_cod_database_code               1528315
Cation distribution and size-strain microstructure analysis in ultrafine Zn-Mn Ferrites obtained from acetylacetonato complexes
Antic, B.; Kremenovic, A.; Stoiljkovic, M.; Nikolic, A.S.; J. Phys. Chem. B 108 (2004) 12646–12651; doi:

data_1528316
_publ_section_title
;
 Cation distribution and size-strain microstructure analysis in ultrafine
 Zn-Mn Ferrites obtained from acetylacetonato complexes
;
_journal_name_full               'J. Phys. Chem. B'
_journal_page_first              12646
_journal_page_last               12651
_journal_volume                  108
_journal_year                    2004
_chemical_formula_sum            'Fe2 Mn O4'
_chemical_name_systematic        'Mn Fe2 O4'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.4983
_cell_length_b                   8.4983
_cell_length_c                   8.4983
_cell_volume                     613.757
_citation_journal_id_ASTM        JPCBFK
_cod_data_source_file            Antic_JPCBFK_2004_619.cif
_cod_data_source_block           Fe2Mn1O4
_cod_original_cell_volume        613.7565
_cod_original_formula_sum        'Fe2 Mn1 O4'
_cod_database_code               1528316
Cation distribution and size-strain microstructure analysis in ultrafine Zn-Mn Ferrites obtained from acetylacetonato complexes
Antic, B.; Kremenovic, A.; Nikolic, A.S.; Stoiljkovic, M.; J. Phys. Chem. B 108 (2004) 12646–12651; doi:

data_1528317
_publ_section_title
;
 Cation distribution and size-strain microstructure analysis in ultrafine
 Zn-Mn Ferrites obtained from acetylacetonato complexes
;
_journal_name_full               'J. Phys. Chem. B'
_journal_page_first              12646
_journal_page_last               12651
_journal_volume                  108
_journal_year                    2004
_chemical_formula_sum            'Fe1.83 Mn0.5 O4 Zn0.41'
_chemical_name_systematic        'Zn0.41 Mn0.50 Fe1.83 O4'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.43813
_cell_length_b                   8.43813
_cell_length_c                   8.43813
_cell_volume                     600.812
_citation_journal_id_ASTM        JPCBFK
_cod_data_source_file            Antic_JPCBFK_2004_620.cif
_cod_data_source_block           Fe1.83Mn0.5O4Zn0.41
_cod_original_cell_volume        600.8121
_cod_database_code               1528317
Cation distribution and size-strain microstructure analysis in ultrafine Zn-Mn Ferrites obtained from acetylacetonato complexes
Antic, B.; Nikolic, A.S.; Kremenovic, A.; Stoiljkovic, M.; J. Phys. Chem. B 108 (2004) 12646–12651; doi:

data_1528318
_publ_section_title
;
 Cation distribution and size-strain microstructure analysis in ultrafine
 Zn-Mn Ferrites obtained from acetylacetonato complexes
;
_journal_name_full               'J. Phys. Chem. B'
_journal_page_first              12646
_journal_page_last               12651
_journal_volume                  108
_journal_year                    2004
_chemical_formula_sum            'Fe1.85 Mn0.67 O4 Zn0.18'
_chemical_name_systematic        'Zn0.18 Mn0.67 Fe1.85 O4'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.4748
_cell_length_b                   8.4748
_cell_length_c                   8.4748
_cell_volume                     608.679
_citation_journal_id_ASTM        JPCBFK
_cod_data_source_file            Antic_JPCBFK_2004_621.cif
_cod_data_source_block           Fe1.85Mn0.67O4Zn0.18
_cod_original_cell_volume        608.6791
_cod_database_code               1528318
Mazzinite-Na, a new zeolite from Boron, California: Its description and crystal structure
Arletti, R.; Vezzalini, G.; Galli, E.; Wise, W.S.; American Mineralogist 90 (2005) 1186–1191; doi:

data_1528319
_publ_section_title
;
 Mazzinite-Na, a new zeolite from Boron, California: Its description and
 crystal structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1186
_journal_page_last               1191
_journal_volume                  90
_journal_year                    2005
_chemical_formula_sum            'Al4.14 Na3.95 O48.62 Si13.86'
_chemical_name_systematic        'Na4 ((Si0.77 Al0.23)18 O36) (H2 O)15'
_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                   18.2343
_cell_length_b                   18.2343
_cell_length_c                   7.6371
_cell_volume                     2199.061
_citation_journal_id_ASTM        AMMIAY
_cod_data_source_file            Arletti_AMMIAY_2005_636.cif
_cod_data_source_block           Al4.14Na3.95O48.62Si13.86
_cod_database_code               1528319
Origin of diffuse superstructure reflections in labuntsovite-group minerals
Armbruster, T.; Krivovichev, S.V.; Organova, N.N.; Weber, T.; Gnos, E.; Yakovenchuk, V.N.; Shlyukova, Z.V.; American Mineralogist 89 (2004) 1655–1666; doi:

data_1528320
_publ_section_title
;
 Origin of diffuse superstructure reflections in labuntsovite-group
 minerals
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1655
_journal_page_last               1666
_journal_volume                  89
_journal_year                    2004
_chemical_formula_sum            'Ba2 H20 K4 Mn Na4 O66 Si16 Ti8'
_chemical_name_systematic
'Na4 K4 Ba2 Mn Ti8 (Si4 O12)4 (O H)16 (H2 O)2'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-I 2y'
_symmetry_space_group_name_H-M   'I 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 116.709
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   14.2446
_cell_length_b                   13.7884
_cell_length_c                   15.5
_cell_volume                     2719.528
_citation_journal_id_ASTM        AMMIAY
_cod_data_source_file            Armbruster_AMMIAY_2004_762.cif
_cod_data_source_block           H20Ba2K4Mn1Na4O66Si16Ti8
_cod_original_sg_symbol_Hall     '-C 2y (x,y,-x+z)'
_cod_original_formula_sum        'H20 Ba2 K4 Mn1 Na4 O66 Si16 Ti8'
_cod_database_code               1528320
New sodalite frameworks; synthetic tugtupite and a beryllosilicate framework with a 3:1 Si:Be ratio
Armstrong, J.A.; Weller, M.T.; DALTON TRANSACTIONS (CAMBRIDGE, ENGLAND : 2003) 2006 (2006) 2998–3005; doi:

data_7035744
_publ_section_title
;
 New sodalite frameworks; synthetic tugtupite and a beryllosilicate
 framework with a 3:1 Si:Be ratio
;
_journal_name_full
'DALTON TRANSACTIONS (CAMBRIDGE, ENGLAND : 2003)'
_journal_page_first              2998
_journal_page_last               3005
_journal_volume                  2006
_journal_year                    2006
_chemical_formula_sum            'Be3 Cl2 Na8 O24 Si9'
_chemical_name_systematic        'Na8 (Be3 Si9 O24) Cl2'
_space_group_IT_number           217
_symmetry_space_group_name_Hall  'I -4 2 3'
_symmetry_space_group_name_H-M   'I -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   8.6894
_cell_length_b                   8.6894
_cell_length_c                   8.6894
_cell_volume                     656.099
_citation_journal_id_ASTM        DTARAF
_cod_data_source_file            Armstrong_DTARAF_2006_978.cif
_cod_data_source_block           Be3Cl2Na8O24Si9
_cod_original_cell_volume        656.0989
_cod_database_code               7035744
New sodalite frameworks; synthetic tugtupite and a beryllosilicate framework with a 3:1 Si:Be ratio
Armstrong, J.A.; Weller, M.T.; DALTON TRANSACTIONS (CAMBRIDGE, ENGLAND : 2003) 2006 (2006) 2998–3005; doi:

data_7035745
_publ_section_title
;
 New sodalite frameworks; synthetic tugtupite and a beryllosilicate
 framework with a 3:1 Si:Be ratio
;
_journal_name_full
'DALTON TRANSACTIONS (CAMBRIDGE, ENGLAND : 2003)'
_journal_page_first              2998
_journal_page_last               3005
_journal_volume                  2006
_journal_year                    2006
_chemical_formula_sum            'Al2 Be2 Cl2 Na8 O24 Si8'
_chemical_name_systematic        'Na8 (Al2 Be2 Si8 O24) Cl2'
_space_group_IT_number           217
_symmetry_space_group_name_Hall  'I -4 2 3'
_symmetry_space_group_name_H-M   'I -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   8.7298
_cell_length_b                   8.7298
_cell_length_c                   8.7298
_cell_volume                     665.293
_citation_journal_id_ASTM        DTARAF
_cod_data_source_file            Armstrong_DTARAF_2006_980.cif
_cod_data_source_block           Al2Be2Cl2Na8O24Si8
_cod_database_code               7035745
New sodalite frameworks; synthetic tugtupite and a beryllosilicate framework with a 3:1 Si:Be ratio
Armstrong, J.A.; Weller, M.T.; DALTON TRANSACTIONS (CAMBRIDGE, ENGLAND : 2003) 2006 (2006) 2998–3005; doi:

data_7035746
_publ_section_title
;
 New sodalite frameworks; synthetic tugtupite and a beryllosilicate
 framework with a 3:1 Si:Be ratio
;
_journal_name_full
'DALTON TRANSACTIONS (CAMBRIDGE, ENGLAND : 2003)'
_journal_page_first              2998
_journal_page_last               3005
_journal_volume                  2006
_journal_year                    2006
_chemical_formula_sum            'Al4 Be Cl2 Na8 O24 Si7'
_chemical_name_systematic        'Na8 (Al4 Be Si7 O24) Cl2'
_space_group_IT_number           217
_symmetry_space_group_name_Hall  'I -4 2 3'
_symmetry_space_group_name_H-M   'I -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   8.8184
_cell_length_b                   8.8184
_cell_length_c                   8.8184
_cell_volume                     685.756
_citation_journal_id_ASTM        DTARAF
_cod_data_source_file            Armstrong_DTARAF_2006_984.cif
_cod_data_source_block           Al4Be1Cl2Na8O24Si7
_cod_original_cell_volume        685.7557
_cod_original_formula_sum        'Al4 Be1 Cl2 Na8 O24 Si7'
_cod_database_code               7035746
New sodalite frameworks; synthetic tugtupite and a beryllosilicate framework with a 3:1 Si:Be ratio
Armstrong, J.A.; Weller, M.T.; DALTON TRANSACTIONS (CAMBRIDGE, ENGLAND : 2003) 2006 (2006) 2998–3005; doi:

data_7035747
_publ_section_title
;
 New sodalite frameworks; synthetic tugtupite and a beryllosilicate
 framework with a 3:1 Si:Be ratio
;
_journal_name_full
'DALTON TRANSACTIONS (CAMBRIDGE, ENGLAND : 2003)'
_journal_page_first              2998
_journal_page_last               3005
_journal_volume                  2006
_journal_year                    2006
_chemical_formula_sum            'Al4 Be Br2 Na8 O24 Si7'
_chemical_name_systematic        'Na8 (Al4 Be Si7 O24) Br2'
_space_group_IT_number           217
_symmetry_space_group_name_Hall  'I -4 2 3'
_symmetry_space_group_name_H-M   'I -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   8.8799
_cell_length_b                   8.8799
_cell_length_c                   8.8799
_cell_volume                     700.203
_citation_journal_id_ASTM        DTARAF
_cod_data_source_file            Armstrong_DTARAF_2006_985.cif
_cod_data_source_block           Al4Be1Br2Na8O24Si7
_cod_original_cell_volume        700.2034
_cod_original_formula_sum        'Al4 Be1 Br2 Na8 O24 Si7'
_cod_database_code               7035747
The crystal structure of and valency distribution in the low-temperature modification of V3 O5. The decisive importance of a few very weak reflexions in a crystal-structure
Asbrink, S.; Acta Crystallographica B (24,1968-38,1982) 36 (1980) 1332–1339; doi:

data_2106479
_publ_section_title
;
 The crystal structure of and valency distribution in the low-temperature
 modification of V3 O5. The decisive importance of a few very weak
 reflexions in a crystal-structure
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1332
_journal_page_last               1339
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'O5 V3'
_chemical_name_systematic        'V3 O5'
_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                 109.478
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.859
_cell_length_b                   5.0416
_cell_length_c                   6.991
_cell_volume                     327.602
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Asbrink_ACBCAR_1980_70.cif
_cod_data_source_block           O5V3
_cod_original_cell_volume        327.6017
_cod_database_code               2106479
The crystal structure of L-Sb O F
Astroem, A.; Andersson, S.; Journal of Solid State Chemistry 6 (1973) 191–194; doi:

data_1528321
_publ_section_title
;
 The crystal structure of L-Sb O F
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              191
_journal_page_last               194
_journal_volume                  6
_journal_year                    1973
_chemical_formula_sum            'F O Sb'
_chemical_name_systematic        'Sb O F'
_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                   8.873
_cell_length_b                   4.099
_cell_length_c                   5.483
_cell_volume                     199.419
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Astroem_JSSCBI_1973_1999.cif
_cod_data_source_block           F1O1Sb1
_cod_original_cell_volume        199.4191
_cod_original_formula_sum        'F1 O1 Sb1'
_cod_database_code               1528321
Magnetic and crystal structures of Ce C2. Pr C2, Nd C2, Tb C2 and Ho C2 at low temperatures
Atoji, M.; Journal of Chemical Physics 46 (1967) 1891–1901; doi:

data_1528322
_publ_section_title
;
 Magnetic and crystal structures of Ce C2. Pr C2, Nd C2, Tb C2 and Ho C2
 at low temperatures
;
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              1891
_journal_page_last               1901
_journal_volume                  46
_journal_year                    1967
_chemical_formula_sum            'C2 Ce'
_chemical_name_systematic        'Ce C2'
_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            2
_cell_length_a                   3.875
_cell_length_b                   3.875
_cell_length_c                   6.477
_cell_volume                     97.256
_citation_journal_id_ASTM        JCPSA6
_cod_data_source_file            Atoji_JCPSA6_1967_447.cif
_cod_data_source_block           C2Ce1
_cod_original_cell_volume        97.25621
_cod_original_formula_sum        'C2 Ce1'
_cod_database_code               1528322