LMucko/crystallography-open-database huggingface dataset:
Crystal chemistry of the CeCu2-type structure
Debray, D.; Journal of the Less-Common Metals 30 (1973) 237–237; doi:

data_1539735
_publ_section_title
;
 Crystal chemistry of the CeCu2-type structure
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              237
_journal_page_last               237
_journal_volume                  30
_journal_year                    1973
_chemical_formula_sum            'Tm Zn2'
_space_group_IT_number           74
_symmetry_space_group_name_Hall  '-I 2b 2'
_symmetry_space_group_name_H-M   'I m m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.433
_cell_length_b                   6.949
_cell_length_c                   7.597
_cell_volume                     234.025
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Debray_JCOMAH_1973_198.cif
_cod_data_source_block           Tm1Zn2
_cod_original_formula_sum        'Tm1 Zn2'
_cod_database_code               1539735
Sur l'existence d'une transformation directe ? ? dans l'uranium disperse dans un milieu inerte
Besson, J.; Blum, P.L.; Laugier, J.; Journal of Nuclear Materials 16 (1965) 74–75; doi:

data_1539736
_publ_section_title
;
 Sur l'existence d'une transformation directe ? ? dans l'uranium disperse
 dans un milieu inerte
;
_journal_name_full               'Journal of Nuclear Materials'
_journal_page_first              74
_journal_page_last               75
_journal_volume                  16
_journal_year                    1965
_chemical_formula_sum            U
_space_group_IT_number           229
_symmetry_space_group_name_Hall  '-I 4 2 3'
_symmetry_space_group_name_H-M   'I m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.532
_cell_length_b                   3.532
_cell_length_c                   3.532
_cell_volume                     44.062
_citation_journal_id_ASTM        JNUMAM
_cod_data_source_file            Besson_JNUMAM_1965_202.cif
_cod_data_source_block           U1
_cod_original_cell_volume        44.06179
_cod_original_formula_sum        U1
_cod_database_code               1539736
The Se-U and Te-U systems
Ellert, G.V.; Sevast'yanov, V.G.; Slovyanskikh, V.K.; Russian Journal of Inorganic Chemistry (= Zhurnal Neorganicheskoi Khimii) 20 (1975) 120–124; doi:

data_4031699
_publ_section_title
;
 The Se-U and Te-U systems
;
_journal_name_full
;
Russian Journal of Inorganic Chemistry (= Zhurnal Neorganicheskoi Khimii)
;
_journal_page_first              120
_journal_page_last               124
_journal_volume                  20
_journal_year                    1975
_chemical_formula_sum            'Te4 U3'
_chemical_name_systematic        'U3 Te4'
_space_group_IT_number           220
_symmetry_space_group_name_Hall  'I -4bd 2c 3'
_symmetry_space_group_name_H-M   'I -4 3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.38
_cell_length_b                   9.38
_cell_length_c                   9.38
_cell_volume                     825.294
_citation_journal_id_ASTM        RJICAQ
_cod_data_source_file            Ellert_RJICAQ_1975_141.cif
_cod_data_source_block           Te4U3
_cod_original_cell_volume        825.2937
_cod_database_code               4031699
Structures of sodium alumino-germanate sodalites (Na8 (Al6 Ge6 O24) A2, A= Cl, Br, I)
Fleet, M.E.; Acta Crystallographica C (39,1983-) 45 (1989) 843–847; doi:

data_2020240
_publ_section_title
;
 Structures of sodium alumino-germanate sodalites (Na8 (Al6 Ge6 O24) A2,
 A= Cl, Br, I)
;
_journal_name_full               'Acta Crystallographica C (39,1983-)'
_journal_page_first              843
_journal_page_last               847
_journal_volume                  45
_journal_year                    1989
_chemical_formula_sum            'Al6 Br2 Ge6 Na8 O24'
_chemical_name_systematic        'Na8 (Al6 Ge6 O24) Br2'
_space_group_IT_number           218
_symmetry_space_group_name_Hall  'P -4n 2 3'
_symmetry_space_group_name_H-M   'P -4 3 n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   9.0949
_cell_length_b                   9.0949
_cell_length_c                   9.0949
_cell_volume                     752.305
_citation_journal_id_ASTM        ACSCEE
_cod_data_source_file            Fleet_ACSCEE_1989_732.cif
_cod_data_source_block           Al6Br2Ge6Na8O24
_cod_original_cell_volume        752.3047
_cod_database_code               2020240
Structures of (ND4)2V(SO4)2(D2O)6 and (ND4)2 V.45Zn.55(SO4)2(D2O)6 at 5.8 K by neutron diffraction
Deeth, R.J.; Kucharski, E.S.; Figgis, B.N.; Forsyth, J.B.; Reynolds, P.A.; Australian Journal of Chemistry 41 (1988) 1289–1294; doi:

data_1539737
_publ_section_title
;
 Structures of (ND4)2V(SO4)2(D2O)6 and (ND4)2 V.45Zn.55(SO4)2(D2O)6 at 5.8
 K by neutron diffraction
;
_journal_name_full               'Australian Journal of Chemistry'
_journal_page_first              1289
_journal_page_last               1294
_journal_volume                  41
_journal_year                    1988
_chemical_formula_sum            'D20 N2 O14 S2 V'
_chemical_name_systematic        '(N D4)2 V (S O4)2 (D2 O)6'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 107
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.13
_cell_length_b                   12.32
_cell_length_c                   6.25
_cell_volume                     672.292
_citation_journal_id_ASTM        AJCHAS
_cod_data_source_file            Deeth_AJCHAS_1988_1409.cif
_cod_data_source_block           D20N2O14S2V1
_cod_original_cell_volume        672.2918
_cod_original_sg_symbol_Hall     '-P 2ybc (z,y,-x)'
_cod_original_formula_sum        'D20 N2 O14 S2 V1'
_cod_database_code               1539737
Synthese und Strukturuntersuchungen von Iodocupraten(I). IX Synthese und Kristallstrukturen von Cs3 Cu2 I5 und Rb Cu2 I3
Bigalke, K.P.; Hans, A.; Hartl, H.; Zeitschrift fuer Anorganische und Allgemeine Chemie 563 (1988) 96–104; doi:

data_1539738
_publ_section_title
;
 Synthese und Strukturuntersuchungen von Iodocupraten(I). IX Synthese und
 Kristallstrukturen von Cs3 Cu2 I5 und Rb Cu2 I3
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              96
_journal_page_last               104
_journal_volume                  563
_journal_year                    1988
_chemical_formula_sum            'Cu2 I3 Rb'
_chemical_name_systematic        'Rb (Cu2 I3)'
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.706
_cell_length_b                   13.383
_cell_length_c                   5.728
_cell_volume                     820.699
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Bigalke_ZAACAB_1988_25.cif
_cod_data_source_block           Cu2I3Rb1
_cod_original_cell_volume        820.6987
_cod_original_formula_sum        'Cu2 I3 Rb1'
_cod_database_code               1539738
Hyperfine magnetic field in ferromagnetic U Mn2 Si2 and U Mn2 Ge2
Chaughule, R.S.; Nagarajan, R.; Begum, R.J.; Gupta, L.C.; Shashikala, K.; Kulkarni, A.D.; Vijayaraghavan, R.; Suryanarayana, P.; Raj, P.; Sathyamoorthy, A.; Journal of Alloys Compd. 178 (1992) 385–391; doi:

data_1539739
_publ_section_title
;
 Hyperfine magnetic field in ferromagnetic U Mn2 Si2 and U Mn2 Ge2
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              385
_journal_page_last               391
_journal_volume                  178
_journal_year                    1992
_chemical_formula_sum            'Ge2 Mn2 U'
_chemical_name_systematic        'Mn2 U Ge2'
_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                   3.989
_cell_length_b                   3.989
_cell_length_c                   10.76
_cell_volume                     171.214
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Chaughule_JALCEU_1992_706.cif
_cod_data_source_block           Ge2Mn2U1
_cod_original_cell_volume        171.2144
_cod_original_formula_sum        'Ge2 Mn2 U1'
_cod_database_code               1539739
The occurence of Laves-type phases among transition elements
Elliott, R.P.; Rostoker, W.; Transactions of the American Society for Metals 50 (1958) 617–633; doi:

data_1539740
_publ_section_title
;
 The occurence of Laves-type phases among transition elements
;
_journal_name_full
'Transactions of the American Society for Metals'
_journal_page_first              617
_journal_page_last               633
_journal_volume                  50
_journal_year                    1958
_chemical_formula_sum            'W2 Zr'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.615
_cell_length_b                   7.615
_cell_length_c                   7.615
_cell_volume                     441.580
_citation_journal_id_ASTM        TASEA7
_cod_data_source_file            Elliott_TASEA7_1958_216.cif
_cod_data_source_block           W2Zr1
_cod_original_cell_volume        441.5803
_cod_original_sg_symbol_Hall     '-F 4vw 2vw 3 (x+1/8,y+1/8,z+1/8)'
_cod_original_formula_sum        'W2 Zr1'
_cod_database_code               1539740
Structures of sodium alumino-germanate sodalites (Na8 (Al6 Ge6 O24) A2, A= Cl, Br, I)
Fleet, M.E.; Acta Crystallographica C (39,1983-) 45 (1989) 843–847; doi:

data_2020241
_publ_section_title
;
 Structures of sodium alumino-germanate sodalites (Na8 (Al6 Ge6 O24) A2,
 A= Cl, Br, I)
;
_journal_name_full               'Acta Crystallographica C (39,1983-)'
_journal_page_first              843
_journal_page_last               847
_journal_volume                  45
_journal_year                    1989
_chemical_formula_sum            'Al6 Ge6 I2 Na8 O24'
_chemical_name_systematic        'Na8 (Al6 Ge6 O24) I2'
_space_group_IT_number           218
_symmetry_space_group_name_Hall  'P -4n 2 3'
_symmetry_space_group_name_H-M   'P -4 3 n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   9.1755
_cell_length_b                   9.1755
_cell_length_c                   9.1755
_cell_volume                     772.484
_citation_journal_id_ASTM        ACSCEE
_cod_data_source_file            Fleet_ACSCEE_1989_734.cif
_cod_data_source_block           Al6Ge6I2Na8O24
_cod_original_cell_volume        772.4835
_cod_database_code               2020241
Structures of (ND4)2V(SO4)2(D2O)6 and (ND4)2 V.45Zn.55(SO4)2(D2O)6 at 5.8 K by neutron diffraction
Deeth, R.J.; Figgis, B.N.; Forsyth, J.B.; Kucharski, E.S.; Reynolds, P.A.; Australian Journal of Chemistry 41 (1988) 1289–1294; doi:

data_1539741
_publ_section_title
;
 Structures of (ND4)2V(SO4)2(D2O)6 and (ND4)2 V.45Zn.55(SO4)2(D2O)6 at 5.8
 K by neutron diffraction
;
_journal_name_full               'Australian Journal of Chemistry'
_journal_page_first              1289
_journal_page_last               1294
_journal_volume                  41
_journal_year                    1988
_chemical_formula_sum            'D20 N2 O14 S2 V0.45 Zn0.55'
_chemical_name_systematic        '(N D4)2 (V.45 Zn.55) (S O4)2 (D2 O)6'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 107
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.14
_cell_length_b                   12.32
_cell_length_c                   6.25
_cell_volume                     673.028
_citation_journal_id_ASTM        AJCHAS
_cod_data_source_file            Deeth_AJCHAS_1988_1410.cif
_cod_data_source_block           D20N2O14S2V0.45Zn0.55
_cod_original_cell_volume        673.0282
_cod_original_sg_symbol_Hall     '-P 2ybc (z,y,-x)'
_cod_database_code               1539741
Synthese und Strukturuntersuchungen von Iodocupraten(I). IX Synthese und Kristallstrukturen von Cs3 Cu2 I5 und Rb Cu2 I3
Bigalke, K.P.; Hans, A.; Hartl, H.; Zeitschrift fuer Anorganische und Allgemeine Chemie 563 (1988) 96–104; doi:

data_1539742
_publ_section_title
;
 Synthese und Strukturuntersuchungen von Iodocupraten(I). IX Synthese und
 Kristallstrukturen von Cs3 Cu2 I5 und Rb Cu2 I3
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              96
_journal_page_last               104
_journal_volume                  563
_journal_year                    1988
_chemical_formula_sum            'Cs3 Cu2 I5'
_chemical_name_systematic        'Cs3 (Cu2 I5)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   14.386
_cell_length_b                   10.147
_cell_length_c                   11.675
_cell_volume                     1704.255
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Bigalke_ZAACAB_1988_28.cif
_cod_data_source_block           Cs3Cu2I5
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_database_code               1539742
Powder crystal data for the high-temperature phases Cu4 In, Cu9 In4(h) and Cu2 In(h)
Che, G.C.; Ellner, M.; Powder Diffraction 7 (1992) 107–108; doi:

data_1539743
_publ_section_title
;
 Powder crystal data for the high-temperature phases Cu4 In, Cu9 In4(h)
 and Cu2 In(h)
;
_journal_name_full               'Powder Diffraction'
_journal_page_first              107
_journal_page_last               108
_journal_volume                  7
_journal_year                    1992
_chemical_formula_sum            'Cu2 In'
_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                   4.2943
_cell_length_b                   4.2943
_cell_length_c                   5.2328
_cell_volume                     83.570
_citation_journal_id_ASTM        PODIE2
_cod_data_source_file            Che_PODIE2_1992_883.cif
_cod_data_source_block           Cu2In1
_cod_original_cell_volume        83.56983
_cod_original_formula_sum        'Cu2 In1'
_cod_database_code               1539743
Struktur von Tl Sn(h) und ihre kristallchemischen Beziehungen zu verwandten Phasen
Ellner, M.; Predel, B.; Zeitschrift fuer Metallkunde 66 (1975) 503–506; doi:

data_1539744
_publ_section_title
;
 Struktur von Tl Sn(h) und ihre kristallchemischen Beziehungen zu
 verwandten Phasen
;
_journal_name_full               'Zeitschrift fuer Metallkunde'
_journal_page_first              503
_journal_page_last               506
_journal_volume                  66
_journal_year                    1975
_chemical_formula_sum            'Sn Tl'
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.112
_cell_length_b                   5.112
_cell_length_c                   4.375
_cell_volume                     114.330
_citation_journal_id_ASTM        ZEMTAE
_cod_data_source_file            Ellner_ZEMTAE_1975_81.cif
_cod_data_source_block           Sn1Tl1
_cod_original_cell_volume        114.3299
_cod_original_formula_sum        'Sn1 Tl1'
_cod_database_code               1539744
Indium antimonide**
Degtyareva, V.F.; Belash, I.T.; Chipenko, G.V.; Rashchupkin, V.I.; Ponyatovskii, E.G.; Soviet Physics - Solid State (New York) 25 (1983) 1712–1715; doi:

data_1539745
_publ_section_title
;
 Indium antimonide**
;
_journal_name_full               'Soviet Physics - Solid State (New York)'
_journal_page_first              1712
_journal_page_last               1715
_journal_volume                  25
_journal_year                    1983
_chemical_formula_sum            'In Sb'
_space_group_IT_number           25
_symmetry_space_group_name_Hall  'P 2 -2'
_symmetry_space_group_name_H-M   'P m m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   5.85
_cell_length_b                   2.99
_cell_length_c                   3.117
_cell_volume                     54.521
_citation_journal_id_ASTM        SPSSA7
_cod_data_source_file            Degtyareva_SPSSA7_1983_505.cif
_cod_data_source_block           In1Sb1
_cod_original_cell_volume        54.52101
_cod_original_formula_sum        'In1 Sb1'
_cod_database_code               1539745
Structure refinements of lead-substituted calcium hydroxyapatite by x-ray powder fitting
Bigi, A.; Ripamonti, A.; Thomas, S.A.; Brueckner, S.; Roveri, N.; Gazzano, M.; Acta Crystallographica B (39,1983-) 45 (1989) 247–251; doi:

data_2107226
_publ_section_title
;
 Structure refinements of lead-substituted calcium hydroxyapatite by x-ray
 powder fitting
;
_journal_name_full               'Acta Crystallographica B (39,1983-)'
_journal_page_first              247
_journal_page_last               251
_journal_volume                  45
_journal_year                    1989
_chemical_formula_sum            'Ca3.93 H O13 P3 Pb1.07'
_chemical_name_systematic        'Ca3.93 Pb1.07 (P O4)3 (O H)'
_space_group_IT_number           176
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   9.491
_cell_length_b                   9.491
_cell_length_c                   6.953
_cell_volume                     542.409
_citation_journal_id_ASTM        ASBSDK
_cod_data_source_file            Bigi_ASBSDK_1989_683.cif
_cod_data_source_block           H1Ca3.93O13P3Pb1.07
_cod_original_cell_volume        542.4089
_cod_original_formula_sum        'H1 Ca3.93 O13 P3 Pb1.07'
_cod_database_code               2107226
A structural analysis of barium magnesium hollandites
Cheary, R.W.; Squadrito, R.; Acta Crystallographica B (39,1983-) 45 (1989) 205–212; doi:

data_2107227
_publ_section_title
;
 A structural analysis of barium magnesium hollandites
;
_journal_name_full               'Acta Crystallographica B (39,1983-)'
_journal_page_first              205
_journal_page_last               212
_journal_volume                  45
_journal_year                    1989
_chemical_formula_sum            'Ba1.14 Mg1.14 O16 Ti6.86'
_chemical_name_systematic        'Ba1.14 (Mg1.14 Ti6.86) O16'
_space_group_crystal_system      monoclinic
_space_group_IT_number           12
_space_group_name_Hall           '-I 2y'
_space_group_name_H-M_alt        'I 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.489
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   10.1816
_cell_length_b                   2.9733
_cell_length_c                   10.0268
_cell_volume                     303.530
_citation_journal_id_ASTM        ASBSDK
_cod_data_source_file            Cheary_ASBSDK_1989_679.cif
_cod_data_source_block           Ba1.14Mg1.14O16Ti6.86
_cod_depositor_comments
;
 Updating space group information.

 Antanas Vaitkus,
 2018-07-22
;
_cod_original_cell_volume        303.5298
_cod_database_code               2107227
Preparation, characterization and crystal structure of neodymium cyclohexaphosphate hexahydrate: Nd2 P6 O18 . 6 (H2 O)
Elmokhtar, O.S.M.; Rzaigui, M.; Bulletin des Societes chimiques Belges 105 (1996) 307–315; doi:

data_1539746
_publ_section_title
;
 Preparation, characterization and crystal structure of neodymium
 cyclohexaphosphate hexahydrate: Nd2 P6 O18 . 6 (H2 O)
;
_journal_name_full               'Bulletin des Societes chimiques Belges'
_journal_page_first              307
_journal_page_last               315
_journal_volume                  105
_journal_year                    1996
_chemical_formula_sum            'H12 Nd2 O24 P6'
_chemical_name_systematic        'Nd2 (P6 O18) (H2 O)6'
_space_group_IT_number           5
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 93.97
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   24.58
_cell_length_b                   9.2
_cell_length_c                   12.14
_cell_volume                     2738.704
_citation_journal_id_ASTM        BSCBAG
_cod_data_source_file            Elmokhtar_BSCBAG_1996_1763.cif
_cod_data_source_block           H12Nd2O24P6
_cod_database_code               1539746
The structure of magnetite: Symmetry of cubic spinels
Fleet, Michael E.; Journal of Solid State Chemistry 62 (1986) 75–82; doi:10.1016/0022-4596(86)90218-5

data_1539747
_publ_section_title
;
 The structure of magnetite: Symmetry of cubic spinels
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              75
_journal_page_last               82
_journal_paper_doi               10.1016/0022-4596(86)90218-5
_journal_volume                  62
_journal_year                    1986
_chemical_compound_source
'Sample No. 633A, Dana Collection, University of Western Ontario'
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_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            8
_cell_length_a                   8.3941(7)
_cell_length_b                   8.3941(7)
_cell_length_c                   8.3941(7)
_cell_volume                     591.456
_citation_journal_id_ASTM        JSSCBI
_database_code_amcsd             0020590
_exptl_crystal_density_diffrn    5.200
_cod_data_source_file            16796.cif
_cod_data_source_block           16796
_cod_database_code               1539747