LMucko/crystallography-open-database huggingface dataset:
Structure of Tl2Mo2P2O11 _cod_database_code 1001592
Guesdon, A.; Borel, M.; Grandin, A.; Leclaire, A.; Raveau, B.; Acta Crystallographica, Section C 49 (1993) 1877–1879; doi:10.1107/S0108270193004287

data_9015089
_publ_section_title
;
 Structure of Tl2Mo2P2O11
 _cod_database_code 1001592
;
_journal_name_full               'Acta Crystallographica, Section C'
_journal_page_first              1877
_journal_page_last               1879
_journal_paper_doi               10.1107/S0108270193004287
_journal_volume                  49
_journal_year                    1993
_chemical_formula_sum            'Mo4 O22 P4 Tl4'
_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                 97.64
_cell_angle_gamma                90
_cell_length_a                   9.945
_cell_length_b                   10.156
_cell_length_c                   9.974
_cell_formula_units_Z            2
_cell_volume                     998.446
_database_code_amcsd             0010287
_exptl_crystal_density_diffrn    5.579
_cod_duplicate_entry             1001592
_cod_original_cell_volume        998.445
_cod_original_formula_sum        'Mo4 P4 Tl4 O22'
_cod_database_code               9015089
_amcsd_formula_title             Tl2Mo2P2O11
Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Elbaite 55224
Grice, J. D.; Ercit, T. S.; Neues Jahrbuch fur Mineralogie, Abhandlungen 165 (1993) 245–266; doi:

data_9015090
_publ_section_title
;
 Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula
 Sample: Elbaite 55224
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Abhandlungen'
_journal_page_first              245
_journal_page_last               266
_journal_volume                  165
_journal_year                    1993
_chemical_compound_source        'Minas Gerais, Brazil'
_chemical_formula_sum
'Al7.53 B3.18 Ca0.03 F0.63 Fe0.03 H3.33 Li1.02 Mn0.39 Na0.66 O30.36 Si5.82'
_chemical_name_mineral           Fluor-elbaite
_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                   15.846
_cell_length_b                   15.846
_cell_length_c                   7.119
_cell_volume                     1548.064
_database_code_amcsd             0018794
_exptl_crystal_density_diffrn    3.053
_cod_original_sg_symbol_H-M      'R 3 m'
_cod_original_formula_sum
'Na.66 Ca.03 Al7.53 Li1.02 Mn.39 Fe.03 Si5.82 B3.18 F.63 O30.36 H3.33'
_cod_database_code               9015090
Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 250 K
Knight, K. S.; Henderson, C. M. B.; European Journal of Mineralogy 19 (2007) 189–200; doi:10.1127/0935-1221/2007/0019-1711

data_9015091
_publ_section_title
;
 Structural basis for the anomalous low-temperature thermal expansion
 behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10
 Sample: T = 250 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              189
_journal_page_last               200
_journal_paper_doi               10.1127/0935-1221/2007/0019-1711
_journal_volume                  19
_journal_year                    2007
_chemical_formula_sum            'Ba0.5 Cu O10 Si4 Sr0.5'
_chemical_name_mineral           Effenbergerite
_space_group_IT_number           130
_symmetry_space_group_name_Hall  '-P 4a 2ac'
_symmetry_space_group_name_H-M   'P 4/n c c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.39428
_cell_length_b                   7.39428
_cell_length_c                   15.8573
_cell_formula_units_Z            4
_cell_volume                     867.004
_database_code_amcsd             0007205
_exptl_crystal_density_diffrn    3.435
_cod_original_sg_symbol_H-M      'P 4/n c c'
_cod_original_formula_sum        '(Ba.5 Sr.5) Cu Si4 O10'
_cod_database_code               9015091
Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F.; Acta Chemica Scandinavica A 33 (1979) 469–480; doi:

data_9015092
_publ_section_title
;
 Compounds with the marcasite type crystal structure. XIII. Structural and
 magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2
;
_journal_name_full               'Acta Chemica Scandinavica A'
_journal_page_first              469
_journal_page_last               480
_journal_volume                  33
_journal_year                    1979
_chemical_formula_sum            'As2 Fe0.37 Ni0.63'
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.3971
_cell_length_b                   6.1893
_cell_length_c                   2.9539
_cell_formula_units_Z            2
_cell_volume                     98.673
_database_code_amcsd             0011951
_exptl_crystal_density_diffrn    6.983
_cod_original_formula_sum        '(Fe.37 Ni.63) As2'
_cod_database_code               9015092
_amcsd_formula_title             Cr.63Fe.37As2
Structure cristalline de Na Sb F3 (N O3) (H2 O). Etude de la liaison hydrogene O-H-X (X=Cl, Br, (N O3) ) _cod_database_code 1008120
Bourgault, M.; Ducourant, B.; Mascherpa Corral, D.; Fourcade, R.; Journal of Fluorine Chemistry 17 (1981) 305–315; doi:10.1016/S0022-1139(00)81777-7

data_9015093
_publ_section_title
;
 Structure cristalline de Na Sb F3 (N O3) (H2 O). Etude de la
 liaison hydrogene O-H-X (X=Cl, Br, (N O3) )
 _cod_database_code 1008120
;
_journal_name_full               'Journal of Fluorine Chemistry'
_journal_page_first              305
_journal_page_last               315
_journal_paper_doi               10.1016/S0022-1139(00)81777-7
_journal_volume                  17
_journal_year                    1981
_chemical_formula_sum            'F3 N Na O4 Sb'
_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_length_a                   18.18
_cell_length_b                   11.505
_cell_length_c                   5.660
_cell_formula_units_Z            8
_cell_volume                     1183.851
_database_code_amcsd             0016062
_exptl_crystal_density_diffrn    3.139
_cod_duplicate_entry             1008120
_cod_original_formula_sum        'Sb Na F3 O4 N'
_cod_database_code               9015093
_amcsd_formula_title             'F3 H2 N Na O4 Sb'
The Crystal Structure of Cesium Enneachlordithalliate, Cs3 Tl2 Cl9 _cod_database_code 1010869
Hoard, J.; Goldstein, L.; Journal of Chemical Physics 3 (1935) 199–202; doi:10.1063/1.1749633

data_9015094
_publ_section_title
;
 The Crystal Structure of Cesium Enneachlordithalliate, Cs3 Tl2 Cl9
 _cod_database_code 1010869
;
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              199
_journal_page_last               202
_journal_paper_doi               10.1063/1.1749633
_journal_volume                  3
_journal_year                    1935
_chemical_formula_sum            'Cl6 Cs3 Tl'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-P 3* 2n'
_symmetry_space_group_name_H-M   'R -3 c :R'
_cell_angle_alpha                83.8
_cell_angle_beta                 83.8
_cell_angle_gamma                83.8
_cell_length_a                   9.58
_cell_length_b                   9.58
_cell_length_c                   9.58
_cell_formula_units_Z            4
_cell_volume                     864.825
_database_code_amcsd             0017540
_exptl_crystal_density_diffrn    6.266
_cod_duplicate_entry             1010869
_cod_original_sg_symbol_H-M      'R -3 c'
_cod_original_formula_sum        'Tl Cs3 Cl6'
_cod_database_code               9015094
_amcsd_formula_title             'Cl9 Cs3 Tl2'
Compounds with the skutterudite type crystal structure. III. Structural data for arsenides and antimonides,
Kjekshus, A.; Rakke, T.; Acta Chemica Scandinavica A 28 (1974) 99–103; doi:

data_9015095
_publ_section_title
;
 Compounds with the skutterudite type crystal structure.
 III. Structural data for arsenides and antimonides,
;
_journal_name_full               'Acta Chemica Scandinavica A'
_journal_page_first              99
_journal_page_last               103
_journal_volume                  28
_journal_year                    1974
_chemical_compound_source        Synthetic
_chemical_formula_sum            'As3 Rh'
_space_group_IT_number           204
_symmetry_space_group_name_Hall  '-I 2 2 3'
_symmetry_space_group_name_H-M   'I m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.4507
_cell_length_b                   8.4507
_cell_length_c                   8.4507
_cell_formula_units_Z            8
_cell_volume                     603.501
_database_code_amcsd             0017607
_exptl_crystal_density_diffrn    7.213
_cod_original_sg_symbol_H-M      'I m 3'
_cod_original_formula_sum        'Rh As3'
_cod_database_code               9015095
_amcsd_formula_title             RhAs3
Thermal expansion of alunite up to dehydroxylation and collapse of the crystal structure Note: T = 100 C
Zema, M.; Callegari, A. M.; Tarantino, S. C.; Gasparini, E.; Ghigna, P.; Mineralogical Magazine 76 (2012) 613–623; doi:10.1180/minmag.2012.076.3.12

data_9015096
_publ_section_title
;
 Thermal expansion of alunite up to dehydroxylation
 and collapse of the crystal structure
 Note: T = 100 C
;
_journal_name_full               'Mineralogical Magazine'
_journal_page_first              613
_journal_page_last               623
_journal_paper_doi               10.1180/minmag.2012.076.3.12
_journal_volume                  76
_journal_year                    2012
_chemical_compound_source        Hungary
_chemical_formula_sum            'Al2.925 H6.147 K0.876 Na0.071 O14.049 S2'
_chemical_name_mineral           Alunite
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   6.9771
_cell_length_b                   6.9771
_cell_length_c                   17.360
_cell_formula_units_Z            3
_cell_volume                     731.864
_database_code_amcsd             0018985
_exptl_crystal_density_diffrn    2.790
_cod_depositor_comments
;
 Adding the _atom_site_type_symbol data item.

 Antanas Vaitkus,
 2017-01-17
;
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'K.876 Na.071 H6.147 O14.049 Al2.925 S2'
_cod_database_code               9015096
The crystal structure of nuffieldite, Pb2Cu(Pb,Bi)Bi2S7
Kohatsu, I.; Wuensch, B. J.; Zeitschrift fur Kristallographie 138 (1973) 343–365; doi:

data_9015097
_publ_section_title
;
 The crystal structure of nuffieldite, Pb2Cu(Pb,Bi)Bi2S7
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              343
_journal_page_last               365
_journal_volume                  138
_journal_year                    1973
_chemical_compound_source        'Alice Arm, British Columbia, Canada'
_chemical_formula_sum            'Bi2.5 Cu Pb2.5 S7'
_chemical_name_mineral           Nuffieldite
_space_group_IT_number           53
_symmetry_space_group_name_Hall  '-P 2ab 2ab'
_symmetry_space_group_name_H-M   'P b m n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   14.387
_cell_length_b                   21.011
_cell_length_c                   4.046
_cell_formula_units_Z            8
_cell_volume                     1223.046
_database_code_amcsd             0017790
_exptl_crystal_density_diffrn    14.429
_cod_original_formula_sum        'Pb2.5 Bi2.5 Cu S7'
_cod_database_code               9015097
The structure of the a-cation deficient Perovskite U Nb4 O12
Labeau, M.; Grey, I. E.; Coubert, J. C.; Chenevas, J.; Collomb, A.; Guitel, J. C.; Acta Crystallographica, Section B 41 (1985) 33–41; doi:10.1107/S0108768185001549

data_9015098
_publ_section_title
;
 The structure of the a-cation deficient Perovskite U Nb4 O12
;
_journal_issue                   1
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              33
_journal_page_last               41
_journal_paper_doi               10.1107/S0108768185001549
_journal_volume                  41
_journal_year                    1985
_chemical_formula_sum            'Nb8 O24 U2.05'
_space_group_IT_number           71
_symmetry_space_group_name_Hall  '-I 2 2'
_symmetry_space_group_name_H-M   'I m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   15.424
_cell_length_b                   7.712
_cell_length_c                   15.592
_cell_formula_units_Z            4
_cell_volume                     1854.667
_database_code_amcsd             0016202
_exptl_crystal_density_diffrn    5.785
_cod_duplicate_entry             1008280
_cod_original_formula_sum        'U2.05 Nb8 O24'
_cod_database_code               9015098
_amcsd_formula_title             'Nb4 O12 U'
The chalcogenide phosphate apatites Ca10(PO4)6S, Sr10(PO4)6S, Ba10(PO4)6S and Ca10(PO4)6Se
Henning, P. A.; Adolfsson, E.; Grins, J.; Zeitschrift fur Kristallographie 215 (2000) 226–230; doi:

data_9015099
_publ_section_title
;
 The chalcogenide phosphate apatites Ca10(PO4)6S, Sr10(PO4)6S, Ba10(PO4)6S and Ca10(PO4)6Se
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              226
_journal_page_last               230
_journal_volume                  215
_journal_year                    2000
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Ca10 O24 P6 Se'
_space_group_IT_number           147
_symmetry_space_group_name_Hall  '-P 3'
_symmetry_space_group_name_H-M   'P -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   9.5007
_cell_length_b                   9.5007
_cell_length_c                   6.8406
_cell_formula_units_Z            1
_cell_volume                     534.732
_database_code_amcsd             0019724
_exptl_crystal_density_diffrn    3.259
_cod_original_formula_sum        'Ca10 P6 O24 Se'
_cod_database_code               9015099
_amcsd_formula_title             Ca10(PO4)6Se
Structure cristalline du sel mixte CdCl2(NaCl)2(H2O)3
Boistelle, R.; Pepe, G.; Simon, B.; Leclaire, A.; Acta Crystallographica, Section B 30 (1974) 2200–2203; doi:10.1107/S056774087400673X

data_9015100
_publ_section_title
;
 Structure cristalline du sel mixte CdCl2(NaCl)2(H2O)3
;
_journal_issue                   9
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              2200
_journal_page_last               2203
_journal_paper_doi               10.1107/S056774087400673X
_journal_volume                  30
_journal_year                    1974
_chemical_formula_sum            'Cd1.999 Cl8 Na3.998 O6'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   7.89
_cell_length_b                   7.89
_cell_length_c                   26.52
_cell_formula_units_Z            3
_cell_volume                     1429.744
_database_code_amcsd             0009514
_exptl_crystal_density_diffrn    2.426
_cod_duplicate_entry             1001025
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Cd1.999 Na3.998 Cl8 O6'
_cod_database_code               9015100
_amcsd_formula_title             CdCl2(NaCl)2(H2O)3
New ordered and distorted perovskites: the mixed platinates Ln2 M Pt O6 (Ln = La, Pr, Nd, Sm, Eu, Gd; M = Mg, Co, Ni, Zn) _cod_database_code 1001825
Ouchetto, K.; Archaimbault, F.; Choisnet, J.; Et-Tabirou M; Materials Chemistry and Physics 51 (1997) 117–124; doi:10.1016/S0254-0584(97)80279-9

data_9015101
_publ_section_title
;
 New ordered and distorted perovskites: the mixed platinates Ln2 M Pt O6
 (Ln = La, Pr, Nd, Sm, Eu, Gd; M = Mg, Co, Ni, Zn)
 _cod_database_code 1001825
;
_journal_name_full               'Materials Chemistry and Physics'
_journal_page_first              117
_journal_page_last               124
_journal_paper_doi               10.1016/S0254-0584(97)80279-9
_journal_volume                  51
_journal_year                    1997
_chemical_formula_sum            'La O3 Pt0.501 Zn0.501'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.
_cell_angle_gamma                90
_cell_length_a                   5.5944
_cell_length_b                   5.6879
_cell_length_c                   7.9351
_cell_formula_units_Z            4
_cell_volume                     252.498
_database_code_amcsd             0014212
_exptl_crystal_density_diffrn    8.346
_cod_duplicate_entry             1001825
_cod_original_formula_sum        'La Zn.501 Pt.501 O3'
_cod_database_code               9015101
_amcsd_formula_title             'La2 O6 Pt Zn'
Zur Kristallchemie Magnesium-reicher Turmaline
Schmetzer, K.; Nuber, B.; Abraham, K.; Neues Jahrbuch fur Mineralogie, Abhandlungen 136 (1979) 93–112; doi:

data_9015102
_publ_section_title
;
 Zur Kristallchemie Magnesium-reicher Turmaline
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Abhandlungen'
_journal_page_first              93
_journal_page_last               112
_journal_volume                  136
_journal_year                    1979
_chemical_compound_source        'Gerevi Hills, Tanzania'
_chemical_formula_sum
'Al6.63 B3 Ca0.29 H3.75 K0.02 Mg2.37 Na0.6 O31 Si6'
_chemical_name_mineral           Dravite
_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                   15.923
_cell_length_b                   15.923
_cell_length_c                   7.201
_cell_volume                     1581.151
_database_code_amcsd             0019011
_exptl_crystal_density_diffrn    3.035
_cod_original_sg_symbol_H-M      'R 3 m'
_cod_original_formula_sum
'Na.6 Ca.29 K.02 Mg2.37 Al6.63 Si6 B3 O31 H3.75'
_cod_database_code               9015102
Bie Kristallstrukturen einiger Hexachlorokomplexsalze. _cod_database_code 1010220
Engel, G.; Zeitschrift fur Kristallographie 90 (1935) 341–373; doi:

data_9015103
_publ_section_title
;
 Bie Kristallstrukturen einiger Hexachlorokomplexsalze.
 _cod_database_code 1010220
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              341
_journal_page_last               373
_journal_volume                  90
_journal_year                    1935
_chemical_formula_sum            'Cl6 N2 Se'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   9.935
_cell_length_b                   9.935
_cell_length_c                   9.935
_cell_formula_units_Z            4
_cell_volume                     980.626
_database_code_amcsd             0017156
_exptl_crystal_density_diffrn    2.165
_cod_duplicate_entry             1010220
_cod_original_cell_volume        980.627
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Se N2 Cl6'
_cod_database_code               9015103
_amcsd_formula_title             'Cl6 H8 N2 Se'
Iron silicides and their corresponding oxides: a high-pressure study of Fe5Si3 Note: P = 3.6 GPa
Santamaria-Perez D; Nuss, J.; Haines, J.; Jansen, M.; Vegas, A.; Solid State Sciences 6 (2004) 673–678; doi:10.1016/j.solidstatesciences.2004.03.027

data_9015104
_publ_section_title
;
 Iron silicides and their corresponding oxides: a high-pressure study of Fe5Si3
 Note: P = 3.6 GPa
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              673
_journal_page_last               678
_journal_paper_doi               10.1016/j.solidstatesciences.2004.03.027
_journal_volume                  6
_journal_year                    2004
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Fe5 Si3'
_chemical_name_mineral           Xifengite
_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_length_a                   6.7277
_cell_length_b                   6.7277
_cell_length_c                   4.695
_cell_formula_units_Z            2
_cell_volume                     184.035
_database_code_amcsd             0019672
_exptl_crystal_density_diffrn    6.560
_cod_database_code               9015104
Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 21.57 GPa, T = 1273 K
Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y.; American Mineralogist 97 (2012) 1417–1420; doi:10.2138/am.2012.3958

data_9015105
_publ_section_title
;
 Isothermal compression of face-centered cubic iron
 Note: gamma iron, Sample M605, P = 21.57 GPa, T = 1273 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1417
_journal_page_last               1420
_journal_paper_doi               10.2138/am.2012.3958
_journal_volume                  97
_journal_year                    2012
_chemical_compound_source        Synthetic
_chemical_formula_sum            Fe
_chemical_name_mineral           Iron
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.498
_cell_length_b                   3.498
_cell_length_c                   3.498
_cell_formula_units_Z            4
_cell_volume                     42.802
_database_code_amcsd             0019419
_exptl_crystal_density_diffrn    8.667
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9015105