LMucko/crystallography-open-database huggingface dataset:
Neue Alkalioxoarsenate (V): Zur Kenntnis von Rb2 Li (As O4) und Cs2 Li (As O4)
Schneidersmann, C.; Hoppe, R.; Zeitschrift fuer Anorganische und Allgemeine Chemie 610 (1992) 103–111; doi:

data_1534651
_publ_section_title
;
 Neue Alkalioxoarsenate (V): Zur Kenntnis von Rb2 Li (As O4) und Cs2 Li
 (As O4)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              103
_journal_page_last               111
_journal_volume                  610
_journal_year                    1992
_chemical_formula_sum            'As Li O4 Rb2'
_chemical_name_systematic        'Rb2 Li (As O4)'
_space_group_IT_number           36
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.821
_cell_length_b                   11.711
_cell_length_c                   7.924
_cell_volume                     540.177
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Schneidersmann_ZAACAB_1992_100.cif
_cod_data_source_block           As1Li1O4Rb2
_cod_original_cell_volume        540.1769
_cod_original_formula_sum        'As1 Li1 O4 Rb2'
_cod_database_code               1534651
Crystal structure, magnetic properties, and electronic structure of Ni (N C N H2)4 Cl2 and Co (N C N H2)4 Cl2
Liu, X.-H.; Kroll, P.; Dronskowski, R.; Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 1682–1686; doi:

data_1534652
_publ_section_title
;
 Crystal structure, magnetic properties, and electronic structure of Ni (N
 C N H2)4 Cl2 and Co (N C N H2)4 Cl2
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1682
_journal_page_last               1686
_journal_volume                  627
_journal_year                    2001
_chemical_formula_sum            'C4 H8 Cl2 Co N8'
_chemical_name_systematic        '(Co (N C N H2)4) Cl2'
_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            6
_cell_length_a                   12.6626
_cell_length_b                   12.6626
_cell_length_c                   12.6626
_cell_volume                     2030.340
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Liu_ZAACAB_2001_17.cif
_cod_data_source_block           C4H8Cl2Co1N8
_cod_original_cell_volume        2030.339
_cod_original_formula_sum        'C4 H8 Cl2 Co1 N8'
_cod_database_code               1534652
Crystal structure of tetrapotassium diarsenidomercurate(II): K4 (Hg As2)
Asbrand, M.; Eisenmann, B.; Somer, M.; Zeitschrift fuer Kristallographie - New Crystal Structures 212 (1997) 79–79; doi:

data_8103860
_publ_section_title
;
 Crystal structure of tetrapotassium diarsenidomercurate(II): K4 (Hg As2)
;
_journal_name_full
;
Zeitschrift fuer Kristallographie - New Crystal Structures
;
_journal_page_first              79
_journal_page_last               79
_journal_volume                  212
_journal_year                    1997
_chemical_formula_sum            'As2 Hg K4'
_chemical_name_systematic        'K4 (Hg As2)'
_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_formula_units_Z            3
_cell_length_a                   5.763
_cell_length_b                   5.763
_cell_length_c                   27.696
_cell_volume                     796.608
_citation_journal_id_ASTM        ZKNSFT
_cod_data_source_file            Asbrand_ZKNSFT_1997_1962.cif
_cod_data_source_block           As2Hg1K4
_cod_original_cell_volume        796.6085
_cod_original_formula_sum        'As2 Hg1 K4'
_cod_database_code               8103860
X-ray diffraction determination of the cation distribution and oxygen positional parameter in polycrystalline spinels
Gonzales, J.M.R.; Arean, C.O.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1985 (1985) 2155–2159; doi:

data_4031577
_publ_section_title
;
 X-ray diffraction determination of the cation distribution and oxygen
 positional parameter in polycrystalline spinels
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              2155
_journal_page_last               2159
_journal_volume                  1985
_journal_year                    1985
_chemical_formula_sum            'Al2 Cu0.6 O4 Zn0.4'
_chemical_name_systematic        'Cu.6 Zn.4 Al2 O4'
_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                   8.39
_cell_length_b                   8.39
_cell_length_c                   8.39
_cell_volume                     590.590
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Gonzales_JCDTBI_1985_1591.cif
_cod_data_source_block           Al2Cu0.6O4Zn0.4
_cod_original_cell_volume        590.5898
_cod_original_sg_symbol_Hall     '-F 4vw 2vw 3 (x+1/8,y+1/8,z+1/8)'
_cod_database_code               4031577
Neue Alkalioxoarsenate (V): Zur Kenntnis von Rb2Li(AsO4) und Cs2Li(AsO4)
Schneidersmann, C.; Hoppe, R.; Zeitschrift fuer Anorganische und Allgemeine Chemie 610 (1992) 103–111; doi:

data_1534653
_publ_section_title
;
 Neue Alkalioxoarsenate (V): Zur Kenntnis von Rb2Li(AsO4) und Cs2Li(AsO4)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              103
_journal_page_last               111
_journal_volume                  610
_journal_year                    1992
_chemical_formula_sum            'As Cs2 Li O4'
_chemical_name_systematic        'Cs2 Li (As O4)'
_space_group_IT_number           36
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.964
_cell_length_b                   12.234
_cell_length_c                   8.197
_cell_volume                     598.082
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Schneidersmann_ZAACAB_1992_101.cif
_cod_data_source_block           As1Cs2Li1O4
_cod_original_cell_volume        598.0825
_cod_original_formula_sum        'As1 Cs2 Li1 O4'
_cod_database_code               1534653
Mercury cyanamide/carbodiimide networks: synthesis and crystal structures of Hg2 (N C N) Cl2 and Hg3 (N C N)2 Cl2
Liu, X.-H.; Dronskowski, R.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 57 (2002) 1108–1114; doi:

data_7222500
_publ_section_title
;
 Mercury cyanamide/carbodiimide networks: synthesis and crystal structures
 of Hg2 (N C N) Cl2 and Hg3 (N C N)2 Cl2
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              1108
_journal_page_last               1114
_journal_volume                  57
_journal_year                    2002
_chemical_formula_sum            'C Cl2 Hg2 N2'
_chemical_name_systematic        'Hg2 (N C N) Cl2'
_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                 106.446
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.0667
_cell_length_b                   9.0705
_cell_length_c                   7.8802
_cell_volume                     552.996
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Liu_ZNBSEN_2002_721.cif
_cod_data_source_block           C1Cl2Hg2N2
_cod_original_cell_volume        552.9965
_cod_original_formula_sum        'C1 Cl2 Hg2 N2'
_cod_database_code               7222500
Crystal structure, vibrational spectra and thermal decomposition of a new tetrazinc(II) dipyrophosphate decahydrate, Zn~4~(P~2~O~7~)~2~.~10~H~2~O
Assaaoudi, H.; Belanger-Gariepy, F.; Butler, I. S.; Kozinski, J.; Journal of Chemical Crystallography 35 (2005) 49–59; doi:10.1007/s10870-005-1154-7

data_1534654
_publ_section_title
;
 Crystal structure, vibrational spectra and thermal decomposition of a new
 tetrazinc(II) dipyrophosphate decahydrate, Zn~4~(P~2~O~7~)~2~.~10~H~2~O
;
_journal_issue                   1
_journal_name_full               'Journal of Chemical Crystallography'
_journal_page_first              49
_journal_page_last               59
_journal_paper_doi               10.1007/s10870-005-1154-7
_journal_volume                  35
_journal_year                    2005
_chemical_formula_sum            'H20 O24 P4 Zn4'
_chemical_name_systematic        'Zn4 (P2 O7)2 (H2 O)10'
_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                   9.1508
_cell_length_b                   25.5271
_cell_length_c                   8.3574
_cell_volume                     1952.233
_citation_journal_id_ASTM        JCCYEV
_cod_data_source_file            Assaaoudi_JCCYEV_2005_1469.cif
_cod_data_source_block           H20O24P4Zn4
_cod_database_code               1534654
Microstructural investigations of oxygen-deficient Ba Mn O3-y hexagonal perovskites
Gonzalez-Calbet, J.M.; Parras, M.; Alonso, J.M.; Vallet-Regi, M.; Prewitt, C.T.; Journal of Solid State Chemistry 106 (1993) 99–110; doi:

data_1534655
_publ_section_title
;
 Microstructural investigations of oxygen-deficient Ba Mn O3-y hexagonal
 perovskites
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              99
_journal_page_last               110
_journal_volume                  106
_journal_year                    1993
_chemical_formula_sum            'Ba Mn O2.83'
_space_group_IT_number           187
_symmetry_space_group_name_Hall  'P -6 2'
_symmetry_space_group_name_H-M   'P -6 m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            8
_cell_length_a                   5.7
_cell_length_b                   5.7
_cell_length_c                   19
_cell_volume                     534.606
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Gonzalez-Calbet_JSSCBI_1993_1155.cif
_cod_data_source_block           Ba1Mn1O2.83
_cod_original_cell_volume        534.6061
_cod_original_formula_sum        'Ba1 Mn1 O2.83'
_cod_database_code               1534655
Synthese und Struktur des ersten TetraaminophosphoniumSalzes P (N H2)4 I
Schnick, W.; Horstmann, S.; Schmidpeter, A.; Angewandte Chemie (German Edition) 106 (1994) 818–819; doi:10.1002/ange.19941060726

data_1534656
_publ_section_title
;
 Synthese und Struktur des ersten TetraaminophosphoniumSalzes P (N H2)4 I
;
_journal_coden_ASTM              ANCEAD
_journal_name_full               'Angewandte Chemie (German Edition)'
_journal_page_first              818
_journal_page_last               819
_journal_paper_doi               10.1002/ange.19941060726
_journal_volume                  106
_journal_year                    1994
_chemical_formula_sum            'H8 I N4 P'
_chemical_name_systematic        '((N H2)4 P) I'
_space_group_IT_number           125
_symmetry_space_group_name_Hall  '-P 4a 2b'
_symmetry_space_group_name_H-M   'P 4/n b m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.426
_cell_length_b                   8.426
_cell_length_c                   4.867
_cell_volume                     345.545
_cod_data_source_file            Schnick_ANCEAD_1994_1623.cif
_cod_data_source_block           H8I1N4P1
_cod_original_cell_volume        345.5447
_cod_original_formula_sum        'H8 I1 N4 P1'
_cod_database_code               1534656
Mercury cyanamide/carbodiimide networks: synthesis and crystal structures of Hg2 (N C N) Cl2 and Hg3 (N C N)2 Cl2
Liu, X.-H.; Dronskowski, R.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 57 (2002) 1108–1114; doi:

data_7222501
_publ_section_title
;
 Mercury cyanamide/carbodiimide networks: synthesis and crystal structures
 of Hg2 (N C N) Cl2 and Hg3 (N C N)2 Cl2
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              1108
_journal_page_last               1114
_journal_volume                  57
_journal_year                    2002
_chemical_formula_sum            'C2 Cl2 Hg3 N4'
_chemical_name_systematic        'Hg3 (N C N)2 Cl2'
_space_group_IT_number           29
_symmetry_space_group_name_Hall  'P 2c -2ac'
_symmetry_space_group_name_H-M   'P c a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.0195
_cell_length_b                   10.785
_cell_length_c                   10.503
_cell_volume                     795.133
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Liu_ZNBSEN_2002_722.cif
_cod_data_source_block           C2Cl2Hg3N4
_cod_original_cell_volume        795.1328
_cod_database_code               7222501
Crystal and electronic structure of the red semiconductor Ba4 La Sb Ge3 Se13 comprising the complex anion (Ge2 Se7-Sb2 Se4-Ge2 Se7)(14-)
Assoud, A.; Soheilnia, N.; Kleinke, H.; Journal of Solid State Chemistry 177 (2004) 2249–2254; doi:

data_1534657
_publ_section_title
;
 Crystal and electronic structure of the red semiconductor Ba4 La Sb Ge3
 Se13 comprising the complex anion (Ge2 Se7-Sb2 Se4-Ge2 Se7)(14-)
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              2249
_journal_page_last               2254
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Ba4 Ge3 La Sb Se13'
_chemical_name_systematic        'Ba4 La (Ge Se4)3 Se Sb'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 103.457
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   16.333
_cell_length_b                   12.5115
_cell_length_c                   13.0321
_cell_volume                     2589.998
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Assoud_JSSCBI_2004_1327.cif
_cod_data_source_block           Ba4Ge3La1Sb1Se13
_cod_original_formula_sum        'Ba4 Ge3 La1 Sb1 Se13'
_cod_database_code               1534657
Microstructural investigations of oxygen-deficient Ba Mn O3-y hexagonal perovskites
Gonzalez-Calbet, J.M.; Parras, M.; Alonso, J.M.; Prewitt, C.T.; Vallet-Regi, M.; Journal of Solid State Chemistry 106 (1993) 99–110; doi:

data_1534658
_publ_section_title
;
 Microstructural investigations of oxygen-deficient Ba Mn O3-y hexagonal
 perovskites
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              99
_journal_page_last               110
_journal_volume                  106
_journal_year                    1993
_chemical_formula_sum            'Ba Mn O2.83'
_space_group_IT_number           187
_symmetry_space_group_name_Hall  'P -6 2'
_symmetry_space_group_name_H-M   'P -6 m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   5.7
_cell_length_b                   5.7
_cell_length_c                   14
_cell_volume                     393.920
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Gonzalez-Calbet_JSSCBI_1993_1162.cif
_cod_data_source_block           Ba1Mn1O2.83
_cod_original_cell_volume        393.9203
_cod_original_formula_sum        'Ba1 Mn1 O2.83'
_cod_database_code               1534658
Cerium chloride oxide
Schnick, W.; Private Communication 2004 (2004) 1–1; doi:

data_1534659
_publ_section_title
;
 Cerium chloride oxide
;
_journal_name_full               'Private Communication'
_journal_page_first              1
_journal_page_last               1
_journal_volume                  2004
_journal_year                    2004
_chemical_formula_sum            'Ce Cl O'
_space_group_IT_number           129
_symmetry_space_group_name_Hall  '-P 4a 2a'
_symmetry_space_group_name_H-M   'P 4/n m m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.0866
_cell_length_b                   4.0866
_cell_length_c                   6.8538
_cell_volume                     114.461
_citation_journal_id_ASTM        PRICO6
_cod_data_source_file            Schnick_PRICO6_2004_360.cif
_cod_data_source_block           Ce1Cl1O1
_cod_original_cell_volume        114.4605
_cod_original_formula_sum        'Ce1 Cl1 O1'
_cod_database_code               1534659
A Novel Method for Synthesizing Crystalline Copper Carbodiimide, CuNCN. Structure Determination by X-Ray Rietveld Refinement
Liu, X; Wankeu, M.A.; Dronskowski, R.; Lueken, H.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 60 (2005) 593–596; doi:

data_7222502
_publ_section_title
;
 A Novel Method for Synthesizing Crystalline Copper Carbodiimide, CuNCN.
 Structure Determination by X-Ray Rietveld Refinement
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              593
_journal_page_last               596
_journal_volume                  60
_journal_year                    2005
_chemical_formula_sum            'C Cu N2'
_chemical_name_systematic        'Cu C N2'
_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                   2.99205
_cell_length_b                   6.17821
_cell_length_c                   9.40031
_cell_volume                     173.770
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Liu_ZNBSEN_2005_1986.cif
_cod_data_source_block           C1Cu1N2
_cod_original_cell_volume        173.7695
_cod_original_formula_sum        'C1 Cu1 N2'
_cod_database_code               7222502
The new semiconducting polychalcogenide Ba2 Sn Se5 exhibiting Se3(2-) units and distorted Sn Se6 octahedra
Assoud, A.; Kleinke, H.; Soheilnia, N.; Journal of Solid State Chemistry 178 (2005) 1087–1093; doi:

data_1534660
_publ_section_title
;
 The new semiconducting polychalcogenide Ba2 Sn Se5 exhibiting Se3(2-)
 units and distorted Sn Se6 octahedra
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1087
_journal_page_last               1093
_journal_volume                  178
_journal_year                    2005
_chemical_formula_sum            'Ba2 Se5 Sn'
_chemical_name_systematic        'Ba2 Sn Se5'
_space_group_IT_number           19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   12.3572
_cell_length_b                   17.2354
_cell_length_c                   18.1337
_cell_volume                     3862.139
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Assoud_JSSCBI_2005_1790.cif
_cod_data_source_block           Ba2Se5Sn1
_cod_original_cell_volume        3862.138
_cod_original_formula_sum        'Ba2 Se5 Sn1'
_cod_database_code               1534660
Synthesis and structure of Na6-x(UO2)3(HxPO4)(PO4)3 (x=0.5)
Gorbunova, Yu.E.; Linde, S.A.; Lavrov, A.V.; Pobedina, A.B.; Doklady Akademii Nauk SSSR 251 (1980) 385–389; doi:

data_1534661
_publ_section_title
;
 Synthesis and structure of Na6-x(UO2)3(HxPO4)(PO4)3 (x=0.5)
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              385
_journal_page_last               389
_journal_volume                  251
_journal_year                    1980
_chemical_formula_sum            'H0.5 Na5.5 O22 P4 U3'
_chemical_name_systematic        'Na5.5 (U O2)3 (H0.5 P O4) (P O4)3'
_space_group_IT_number           1
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                83.96
_cell_angle_beta                 82.29
_cell_angle_gamma                89.44
_cell_formula_units_Z            1
_cell_length_a                   6.675
_cell_length_b                   6.922
_cell_length_c                   10.732
_cell_volume                     488.650
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Gorbunova_DANKAS_1980_1388.cif
_cod_data_source_block           H0.5Na5.5O22P4U3
_cod_original_cell_volume        488.6498
_cod_database_code               1534661
Darstellung, Kristallstruktur und IR-spektroskopische Untersuchung von Phosphor(V)-nitrid-imid, HPN2
Schnick, W.; Luecke, J.; Zeitschrift fuer Anorganische und Allgemeine Chemie 610 (1992) 121–126; doi:

data_1534662
_publ_section_title
;
 Darstellung, Kristallstruktur und IR-spektroskopische Untersuchung von
 Phosphor(V)-nitrid-imid, HPN2
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              121
_journal_page_last               126
_journal_volume                  610
_journal_year                    1992
_chemical_formula_sum            'H N2 P'
_chemical_name_systematic        'P N (N H)'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.6182
_cell_length_b                   4.6182
_cell_length_c                   7.0204
_cell_volume                     149.729
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Schnick_ZAACAB_1992_102.cif
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