LMucko/crystallography-open-database huggingface dataset:
Crystal Structure Refinement of Y2 Cu2 O5 from Single Crystal X-Ray Diffraction Data
Famery, R.; Queyroux, F.; Materials Research Bulletin 24 (1989) 275–281; doi:

data_1529921
_publ_section_title
;
 Crystal Structure Refinement of Y2 Cu2 O5 from Single Crystal X-Ray
 Diffraction Data
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              275
_journal_page_last               281
_journal_volume                  24
_journal_year                    1989
_chemical_formula_sum            'Cu2 O5 Y2'
_chemical_name_systematic        'Y2 Cu2 O5'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P -2ac -2n'
_symmetry_space_group_name_H-M   'P n 21 a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.832
_cell_length_b                   12.491
_cell_length_c                   3.495
_cell_volume                     472.882
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Famery_MRBUAC_1989_1780.cif
_cod_data_source_block           Cu2O5Y2
_cod_original_cell_volume        472.8823
_cod_original_sg_symbol_Hall     'P 2c -2n (-x,z,y)'
_cod_database_code               1529921
Preparations and the crystal structure of 3(Sb F3) 4(Sb F5)
Fawcett, J.; Holloway, J.H.; Edwards, A.J.; Russell, D.R.; Khallow, K.I.; Canadian Journal of Chemistry 67 (1989) 2041–2046; doi:

data_1529922
_publ_section_title
;
 Preparations and the crystal structure of 3(Sb F3) 4(Sb F5)
;
_journal_name_full               'Canadian Journal of Chemistry'
_journal_page_first              2041
_journal_page_last               2046
_journal_volume                  67
_journal_year                    1989
_chemical_formula_sum            'F29 Sb7'
_chemical_name_systematic        'Sb3 Sb4 F29'
_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                 100.3
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.547
_cell_length_b                   13.521
_cell_length_c                   19.551
_cell_volume                     2222.982
_citation_journal_id_ASTM        CJCHAG
_cod_data_source_file            Fawcett_CJCHAG_1989_1934.cif
_cod_data_source_block           F29Sb7
_cod_original_cell_volume        2222.981
_cod_database_code               1529922
Preparation and structure of Azidopentafluorotungsten(VI)
Fawcett, J.; Peacock, R.D.; Russell, D.R.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1980 (1980) 2294–2296; doi:

data_4031444
_publ_section_title
;
 Preparation and structure of Azidopentafluorotungsten(VI)
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              2294
_journal_page_last               2296
_journal_volume                  1980
_journal_year                    1980
_chemical_formula_sum            'F5 N3 W'
_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                 102.4
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.24
_cell_length_b                   9.662
_cell_length_c                   10.835
_cell_volume                     535.767
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Fawcett_JCDTBI_1980_822.cif
_cod_data_source_block           F5N3W1
_cod_original_cell_volume        535.7672
_cod_original_formula_sum        'F5 N3 W1'
_cod_database_code               4031444
Transition-metal tetrafluoride oxide-antimony pentafluoride adducts. Preparation and characterization of the adducts M F4 O Sb F5 (M= Mo, W or Re) and crystal structures of Mo F4 O Sb F5 and Re F4 O Sb F5
Fawcett, J.; Holloway, J.H.; Russell, D.R.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1981 (1981) 1212–1218; doi:

data_4031445
_publ_section_title
;
 Transition-metal tetrafluoride oxide-antimony pentafluoride adducts.
 Preparation and characterization of the adducts M F4 O Sb F5 (M= Mo, W or
 Re) and crystal structures of Mo F4 O Sb F5 and Re F4 O Sb F5
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              1212
_journal_page_last               1218
_journal_volume                  1981
_journal_year                    1981
_chemical_formula_sum            'F9 Mo O Sb'
_chemical_name_systematic        '(Mo F4 O) (Sb F5)'
_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                 93.13
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.47
_cell_length_b                   10.4
_cell_length_c                   9.606
_cell_volume                     745.158
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Fawcett_JCDTBI_1981_939.cif
_cod_data_source_block           F9Mo1O1Sb1
_cod_original_cell_volume        745.1576
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'F9 Mo1 O1 Sb1'
_cod_database_code               4031445
Transition-metal tetrafluoride oxide-antimony pentafluoride adducts. Preparation and characterization of the adducts M F4 O Sb F5 (M= Mo, W or Re) and crystal structures of Mo F4 O Sb F5 and Re F4 O Sb F5
Fawcett, J.; Holloway, J.H.; Russell, D.R.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1981 (1981) 1212–1218; doi:

data_4031446
_publ_section_title
;
 Transition-metal tetrafluoride oxide-antimony pentafluoride adducts.
 Preparation and characterization of the adducts M F4 O Sb F5 (M= Mo, W or
 Re) and crystal structures of Mo F4 O Sb F5 and Re F4 O Sb F5
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              1212
_journal_page_last               1218
_journal_volume                  1981
_journal_year                    1981
_chemical_formula_sum            'F9 O Re Sb'
_chemical_name_systematic        '(Re F4 O) (Sb F5)'
_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                 99.37
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.561
_cell_length_b                   10.198
_cell_length_c                   12.622
_cell_volume                     706.257
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Fawcett_JCDTBI_1981_940.cif
_cod_data_source_block           F9O1Re1Sb1
_cod_original_cell_volume        706.2565
_cod_original_formula_sum        'F9 O1 Re1 Sb1'
_cod_database_code               4031446
Fluoride ion donor properties of U F2 O2, preparation and characterization of the adducts U F2 O2.n Sb F5 (n=2 or 3) and crystal structure of U F2 O2 (Sb F5)3
Fawcett, J.; Laycock, D.; Holloway, J.H.; Russell, D.R.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1982 (1982) 1355–1360; doi:

data_4031447
_publ_section_title
;
 Fluoride ion donor properties of U F2 O2, preparation and
 characterization of the adducts U F2 O2.n Sb F5 (n=2 or 3) and crystal
 structure of U F2 O2 (Sb F5)3
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              1355
_journal_page_last               1360
_journal_volume                  1982
_journal_year                    1982
_chemical_formula_sum            'F17 O2 Sb3 U'
_chemical_name_systematic        'U F2 O2 (Sb F5)3'
_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                 111.16
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.04
_cell_length_b                   12.438
_cell_length_c                   12.147
_cell_volume                     1555.510
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Fawcett_JCDTBI_1982_855.cif
_cod_data_source_block           F17O2Sb3U1
_cod_original_cell_volume        1555.51
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'F17 O2 Sb3 U1'
_cod_database_code               4031447
Production, structure, and properties of novel Niobium chalcogenide halides, Nb X Y
Fedorov, V.E.; Evstaf'ev, V.K.; Mishchenko, A.V.; Kirik, S.D.; Zhurnal Neorganicheskoi Khimii 26 (1981) 2701–2707; doi:

data_1529923
_publ_section_title
;
 Production, structure, and properties of novel Niobium chalcogenide
 halides, Nb X Y
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              2701
_journal_page_last               2707
_journal_volume                  26
_journal_year                    1981
_chemical_formula_sum            'I Nb Se'
_chemical_name_systematic        'Nb Se I'
_space_group_IT_number           216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   10.782
_cell_length_b                   10.782
_cell_length_c                   10.782
_cell_volume                     1253.424
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Fedorov_ZNOKAQ_1981_883.cif
_cod_data_source_block           I1Nb1Se1
_cod_original_formula_sum        'I1 Nb1 Se1'
_cod_database_code               1529923
The crystal structure of zoisite
Fesenko, E.G.; Rumanova, I.M.; Belov, N.V.; Kristallografiya 1 (1956) 171–196; doi:

data_1529924
_publ_section_title
;
 The crystal structure of zoisite
;
_journal_name_full               Kristallografiya
_journal_page_first              171
_journal_page_last               196
_journal_volume                  1
_journal_year                    1956
_chemical_formula_sum            'Al3 Ca2 H O13 Si3'
_chemical_name_systematic        'Ca2 Al3 (Si2 O7) (Si O4) O (O H)'
_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                   16.23
_cell_length_b                   5.51
_cell_length_c                   10.16
_cell_volume                     908.581
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Fesenko_KRISAJ_1956_1469.cif
_cod_data_source_block           H1Al3Ca2O13Si3
_cod_original_cell_volume        908.5814
_cod_original_formula_sum        'H1 Al3 Ca2 O13 Si3'
_cod_database_code               1529924
Crystal structures of the simple monoclinic and orthorhombic polytypes of tripotassium hexacyanoferrate(III)
Figgis, B.N.; Skelton, B.W.; White, A.H.; Australian Journal of Chemistry 31 (1978) 1195–1199; doi:

data_1529925
_publ_section_title
;
 Crystal structures of the simple monoclinic and orthorhombic polytypes of
 tripotassium hexacyanoferrate(III)
;
_journal_name_full               'Australian Journal of Chemistry'
_journal_page_first              1195
_journal_page_last               1199
_journal_volume                  31
_journal_year                    1978
_chemical_formula_sum            'C6 Fe K3 N6'
_chemical_name_systematic        'K3 (Fe (C N)6)'
_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                 107.29
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.047
_cell_length_b                   10.4
_cell_length_c                   8.384
_cell_volume                     586.688
_citation_journal_id_ASTM        AJCHAS
_cod_data_source_file            Figgis_AJCHAS_1978_230.cif
_cod_data_source_block           C6Fe1K3N6
_cod_original_cell_volume        586.6877
_cod_original_formula_sum        'C6 Fe1 K3 N6'
_cod_database_code               1529925
Crystal structures of the simple monoclinic and orthorhombic polytypes of tripotassium hexacyanoferrate(III)
Figgis, B.N.; Skelton, B.W.; White, A.H.; Australian Journal of Chemistry 31 (1978) 1195–1199; doi:

data_1529926
_publ_section_title
;
 Crystal structures of the simple monoclinic and orthorhombic polytypes of
 tripotassium hexacyanoferrate(III)
;
_journal_name_full               'Australian Journal of Chemistry'
_journal_page_first              1195
_journal_page_last               1199
_journal_volume                  31
_journal_year                    1978
_chemical_formula_sum            'C6 Fe K3 N6'
_chemical_name_systematic        'K3 (Fe (C N)6)'
_space_group_IT_number           60
_symmetry_space_group_name_Hall  '-P 2a 2n'
_symmetry_space_group_name_H-M   'P n c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.422
_cell_length_b                   10.399
_cell_length_c                   8.381
_cell_volume                     1169.781
_citation_journal_id_ASTM        AJCHAS
_cod_data_source_file            Figgis_AJCHAS_1978_231.cif
_cod_data_source_block           C6Fe1K3N6
_cod_original_sg_symbol_Hall     '-P 2n 2ab (z,x,y)'
_cod_original_formula_sum        'C6 Fe1 K3 N6'
_cod_database_code               1529926
Crystal structure of Hexaamminecobalt(III) Chloride chromate trihydrate
Figgis, B.N.; Skelton, B.W.; White, A.H.; Australian Journal of Chemistry 32 (1979) 417–419; doi:

data_1529927
_publ_section_title
;
 Crystal structure of Hexaamminecobalt(III) Chloride chromate trihydrate
;
_journal_name_full               'Australian Journal of Chemistry'
_journal_page_first              417
_journal_page_last               419
_journal_volume                  32
_journal_year                    1979
_chemical_formula_sum            'Cl Co Cr H24 N6 O7'
_chemical_name_systematic        '(Co (N H3)6) (Cr O4) Cl (H2 O)3'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2n 2ac'
_symmetry_space_group_name_H-M   'P c m n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.594
_cell_length_b                   8.598
_cell_length_c                   18.126
_cell_volume                     1339.352
_citation_journal_id_ASTM        AJCHAS
_cod_data_source_file            Figgis_AJCHAS_1979_857.cif
_cod_data_source_block           H24Cl1Co1Cr1N6O7
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,y,-x)'
_cod_original_formula_sum        'H24 Cl1 Co1 Cr1 N6 O7'
_cod_database_code               1529927
The crystal structure of deuterated trans-tetraamminedinitronickel(II) at 4.2 K by neutron diffraction
Figgis, B.N.; Williams, G.A.; Reynolds, P.A.; Lehner, N.; Australian Journal of Chemistry 34 (1981) 993–999; doi:

data_1529928
_publ_section_title
;
 The crystal structure of deuterated trans-tetraamminedinitronickel(II) at
 4.2 K by neutron diffraction
;
_journal_name_full               'Australian Journal of Chemistry'
_journal_page_first              993
_journal_page_last               999
_journal_volume                  34
_journal_year                    1981
_chemical_formula_sum            'D12 N6 Ni O4'
_chemical_name_systematic        'Ni (N D3)4 (N O2)2'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 114.82
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   10.58
_cell_length_b                   6.72
_cell_length_c                   5.863
_cell_volume                     378.342
_citation_journal_id_ASTM        AJCHAS
_cod_data_source_file            Figgis_AJCHAS_1981_714.cif
_cod_data_source_block           D12N6Ni1O4
_cod_original_cell_volume        378.3416
_cod_original_formula_sum        'D12 N6 Ni1 O4'
_cod_database_code               1529928
The crystal structure of tricesium tetrabromocobalte(II) bromide, Cs3 Co Br5, at 4.2 K by neutron diffraction
Figgis, B.N.; Reynolds, P.A.; Australian Journal of Chemistry 34 (1981) 2495–2498; doi:

data_1529929
_publ_section_title
;
 The crystal structure of tricesium tetrabromocobalte(II) bromide, Cs3 Co
 Br5, at 4.2 K by neutron diffraction
;
_journal_name_full               'Australian Journal of Chemistry'
_journal_page_first              2495
_journal_page_last               2498
_journal_volume                  34
_journal_year                    1981
_chemical_formula_sum            'Br5 Co Cs3'
_chemical_name_systematic        'Cs3 Co Br5'
_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                   9.46
_cell_length_b                   9.46
_cell_length_c                   15.04
_cell_volume                     1345.954
_citation_journal_id_ASTM        AJCHAS
_cod_data_source_file            Figgis_AJCHAS_1981_766.cif
_cod_data_source_block           Br5Co1Cs3
_cod_original_formula_sum        'Br5 Co1 Cs3'
_cod_database_code               1529929
The electronic structure of copper in the polymer potassium bis(carbonato)cuprate(II) as determined from precise X-Ray diffraction data
Figgis, B.N.; Reynolds, P.A.; White, A.H.; Geoffrey, A.W.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1981 (1981) 371–376; doi:

data_4031448
_publ_section_title
;
 The electronic structure of copper in the polymer potassium
 bis(carbonato)cuprate(II) as determined from precise X-Ray diffraction
 data
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              371
_journal_page_last               376
_journal_volume                  1981
_journal_year                    1981
_chemical_formula_sum            'C2 Cu K2 O6'
_chemical_name_systematic        'K2 (Cu (C O3)2)'
_space_group_IT_number           43
_symmetry_space_group_name_Hall  'F 2 -2d'
_symmetry_space_group_name_H-M   'F d d 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   11.425
_cell_length_b                   17.658
_cell_length_c                   6.154
_cell_volume                     1241.524
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Figgis_JCDTBI_1981_557.cif
_cod_data_source_block           C2Cu1K2O6
_cod_original_formula_sum        'C2 Cu1 K2 O6'
_cod_database_code               4031448
The magnetic, spectral and structural properties of trans-tetra-amminedinitronickel(II)
Figgis, B.N.; Williams, G.A.; Reynolds, P.A.; White, A.H.; Wright, S.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1981 (1981) 997–1003; doi:

data_4031449
_publ_section_title
;
 The magnetic, spectral and structural properties of
 trans-tetra-amminedinitronickel(II)
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              997
_journal_page_last               1003
_journal_volume                  1981
_journal_year                    1981
_chemical_formula_sum            'H12 N6 Ni O4'
_chemical_name_systematic        'Ni (N H3)4 (N O2)2'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 114.8
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   10.628
_cell_length_b                   6.887
_cell_length_c                   5.974
_cell_volume                     396.941
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Figgis_JCDTBI_1981_833.cif
_cod_data_source_block           H12N6Ni1O4
_cod_original_cell_volume        396.9413
_cod_original_formula_sum        'H12 N6 Ni1 O4'
_cod_database_code               4031449
The structure of Tin(II) Thiocyanate
Filby, A.G.; Howie, R.A.; Moser, W.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1978 (1978) 1797–1799; doi:

data_4031450
_publ_section_title
;
 The structure of Tin(II) Thiocyanate
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              1797
_journal_page_last               1799
_journal_volume                  1978
_journal_year                    1978
_chemical_formula_sum            'C2 N2 S2 Sn'
_chemical_name_systematic        'Sn (S C N)2'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                83.13
_cell_angle_beta                 79.38
_cell_angle_gamma                93.33
_cell_formula_units_Z            2
_cell_length_a                   5.665
_cell_length_b                   4.924
_cell_length_c                   10.242
_cell_volume                     277.844
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Filby_JCDTBI_1978_817.cif
_cod_data_source_block           C2N2S2Sn1
_cod_original_cell_volume        277.8437
_cod_original_formula_sum        'C2 N2 S2 Sn1'
_cod_database_code               4031450
Crystal structure of the synthetic barium silicate Ba5 (Si4 O12) (O H)2
Filipenko, O.S.; Pobedimskaya, E.A.; Ponomarev, V.I.; Belov, N.V.; Kheiker, D.M.; Doklady Akademii Nauk SSSR 194 (1970) 83–86; doi:

data_1529930
_publ_section_title
;
 Crystal structure of the synthetic barium silicate Ba5 (Si4 O12) (O H)2
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              83
_journal_page_last               86
_journal_volume                  194
_journal_year                    1970
_chemical_formula_sum            'Ba5 H2 O14 Si4'
_chemical_name_systematic        'Ba5 (Si4 O12) (O H)2'
_space_group_IT_number           128
_symmetry_space_group_name_Hall  '-P 4 2n'
_symmetry_space_group_name_H-M   'P 4/m n c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.745
_cell_length_b                   7.745
_cell_length_c                   11.68
_cell_volume                     700.625
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Filipenko_DANKAS_1970_674.cif
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