LMucko/crystallography-open-database huggingface dataset:
Zwei Mercuri-Ammin-Komplexe: (Hg (N H3)2) (Hg Cl3)2 und (Hg (N H3)4) (Cl O4)2
Nockemann, P.; Meyer, G.; Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 123–128; doi:

data_1536085
_publ_section_title
;
 Zwei Mercuri-Ammin-Komplexe: (Hg (N H3)2) (Hg Cl3)2 und (Hg (N H3)4) (Cl
 O4)2
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              123
_journal_page_last               128
_journal_volume                  629
_journal_year                    2003
_chemical_formula_sum            'Cl2 H12 Hg N4 O8'
_chemical_name_systematic        '(Hg (N H3)4) (Cl O4)2'
_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                 120.352
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.9152
_cell_length_b                   10.843
_cell_length_c                   15.6642
_cell_volume                     1160.109
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Nockemann_ZAACAB_2003_857.cif
_cod_data_source_block           H12Cl2Hg1N4O8
_cod_original_formula_sum        'H12 Cl2 Hg1 N4 O8'
_cod_database_code               1536085
The crystal structures of the low-temperature modifications of deuterium iodide - a neutron study
Cockcroft, J.K.; Simon, A.; Borrmann, H.; Obermeyer, A.; European Journal of Solid State Inorganic Chemistry 25 (1988) 471–481; doi:

data_4031609
_publ_section_title
;
 The crystal structures of the low-temperature modifications of deuterium
 iodide - a neutron study
;
_journal_name_full
'European Journal of Solid State Inorganic Chemistry'
_journal_page_first              471
_journal_page_last               481
_journal_volume                  25
_journal_year                    1988
_chemical_formula_sum            'D I'
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-I 2ya'
_space_group_name_H-M_alt        'I 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 85.435
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   8.8435
_cell_length_b                   11.8832
_cell_length_c                   8.8303
_cell_volume                     925.024
_citation_journal_id_ASTM        EJSCE5
_cod_data_source_file            Cockcroft_EJSCE5_1988_1948.cif
_cod_data_source_block           D1I1
_cod_original_cell_volume        925.0243
_cod_original_formula_sum        'D1 I1'
_cod_database_code               4031609
Morphologie und Struktur des Reddingits, P2 O5 (Fe O)3 (H2 O)3
Eversheim, P.; Kleber, W.; Acta Crystallographica (1,1948-23,1967) 6 (1953) 215–216; doi:

data_2310841
_publ_section_title
;
 Morphologie und Struktur des Reddingits, P2 O5 (Fe O)3 (H2 O)3
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              215
_journal_page_last               216
_journal_volume                  6
_journal_year                    1953
_chemical_formula_sum            'Fe H6 Mn2 O11 P2'
_chemical_name_systematic        'Mn2 Fe (P O4)2 (H2 O)3'
_space_group_IT_number           57
_symmetry_space_group_name_Hall  '-P 2bc 2c'
_symmetry_space_group_name_H-M   'P c m b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.75
_cell_length_b                   10.173
_cell_length_c                   9.59
_cell_volume                     853.642
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Eversheim_ACCRA9_1953_192.cif
_cod_data_source_block           H6Fe1Mn2O11P2
_cod_original_cell_volume        853.6419
_cod_original_sg_symbol_Hall     '-P 2c 2b (-x,z,y)'
_cod_original_formula_sum        'H6 Fe1 Mn2 O11 P2'
_cod_database_code               2310841
Variations of the Fe Ga3 structure type in the systems Co In3-x Znx and Co Ga3-x Znx.
Viklund, P.; Lidin, S.; Journal of Solid State Chemistry 165 (2002) 100–110; doi:

data_1536086
_publ_section_title
;
 Variations of the Fe Ga3 structure type in the systems Co In3-x Znx and
 Co Ga3-x Znx.
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              100
_journal_page_last               110
_journal_volume                  165
_journal_year                    2002
_chemical_formula_sum            'Co4 In12'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   6.8343
_cell_length_b                   6.8343
_cell_length_c                   7.0922
_cell_volume                     331.260
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Viklund_JSSCBI_2002_355.cif
_cod_data_source_block           Co4In12
_cod_original_cell_volume        331.26
_cod_database_code               1536086
Structure de l'Oxypentasulfur de Gallium et de Trilanthane, Ga La3 O S5
Jaulmes, S.; Guittard, M.; Mazurier, A.; Acta Crystallographica C (39,1983-) 39 (1983) 1594–1597; doi:

data_2020152
_publ_section_title
;
 Structure de l'Oxypentasulfur de Gallium et de Trilanthane, Ga La3 O S5
;
_journal_name_full               'Acta Crystallographica C (39,1983-)'
_journal_page_first              1594
_journal_page_last               1597
_journal_volume                  39
_journal_year                    1983
_chemical_formula_sum            'Ga La3 O S5'
_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                   10.78
_cell_length_b                   4.03
_cell_length_c                   19.95
_cell_volume                     866.696
_citation_journal_id_ASTM        ACSCEE
_cod_data_source_file            Jaulmes_ACSCEE_1983_500.cif
_cod_data_source_block           Ga1La3O1S5
_cod_original_cell_volume        866.6959
_cod_original_formula_sum        'Ga1 La3 O1 S5'
_cod_database_code               2020152
Structure refinements of Co3 (P O4)2. A note on the reliability of powder diffraction studies
Nord, A.G.; Stefanidis, T.; Acta Chemica Scandinavica, Series A: (28,1974-) 37 (1983) 715–721; doi:

data_1536087
_publ_section_title
;
 Structure refinements of Co3 (P O4)2. A note on the reliability of powder
 diffraction studies
;
_journal_name_full
'Acta Chemica Scandinavica, Series A: (28,1974-)'
_journal_page_first              715
_journal_page_last               721
_journal_volume                  37
_journal_year                    1983
_chemical_formula_sum            'Co3 O8 P2'
_chemical_name_systematic        'Co3 (P O4)2'
_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                 94.05
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.556
_cell_length_b                   8.371
_cell_length_c                   5.064
_cell_volume                     319.505
_citation_journal_id_ASTM        ACAPCT
_cod_data_source_file            Nord_ACAPCT_1983_578.cif
_cod_data_source_block           Co3O8P2
_cod_original_cell_volume        319.5046
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_database_code               1536087
Preparation, vibrational spectra, and crystal structure of dithionitronium hexachloroantimonate(V), S2 N Sb Cl6
Faggiani, R.; Gillespie, R.J.; Lock, C.J.L.; Tyrer, J.D.; Inorganic Chemistry 17 (1978) 2975–2978; doi:

data_4344270
_publ_section_title
;
 Preparation, vibrational spectra, and crystal structure of
 dithionitronium hexachloroantimonate(V), S2 N Sb Cl6
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              2975
_journal_page_last               2978
_journal_volume                  17
_journal_year                    1978
_chemical_formula_sum            'Cl6 N S2 Sb'
_chemical_name_systematic        '(S2 N) (Sb Cl6)'
_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_formula_units_Z            2
_cell_length_a                   9.299
_cell_length_b                   7.976
_cell_length_c                   7.07
_cell_volume                     524.374
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Faggiani_INOCAJ_1978_21.cif
_cod_data_source_block           Cl6N1S2Sb1
_cod_original_cell_volume        524.3736
_cod_original_formula_sum        'Cl6 N1 S2 Sb1'
_cod_database_code               4344270
Variations of the Fe Ga3 structure type in the systems Co In3-x Znx and Co Ga3-x Znx.
Viklund, P.; Lidin, S.; Berastegui, P.; Haeussermann, U.; Journal of Solid State Chemistry 164 (2002) 100–110; doi:

data_1536088
_publ_section_title
;
 Variations of the Fe Ga3 structure type in the systems Co In3-x Znx and
 Co Ga3-x Znx.
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              100
_journal_page_last               110
_journal_volume                  164
_journal_year                    2002
_chemical_formula_sum            'Co4 Ga9.5 Zn2.5'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   6.312
_cell_length_b                   6.312
_cell_length_c                   6.2418
_cell_volume                     248.682
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Viklund_JSSCBI_2002_356.cif
_cod_data_source_block           Co4Ga9.5Zn2.5
_cod_original_cell_volume        248.6817
_cod_database_code               1536088
High pressure synthesis and structure of a novel clathrate-type compound: Te7+x Si20-x (x = 2.5)
Jaussaud, N.; Pouchard, M.; Cros, C.; Goglio, G.; Ammar, A.; Weill, F.; Gravereau, P.; Solid State Sciences 5 (2003) 1193–1200; doi:

data_1536089
_publ_section_title
;
 High pressure synthesis and structure of a novel clathrate-type compound:
 Te7+x Si20-x (x = 2.5)
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              1193
_journal_page_last               1200
_journal_volume                  5
_journal_year                    2003
_chemical_formula_sum            'Si17.48 Te9.52'
_chemical_name_systematic        'Te7 (Te2.52 Si5.48) Si12'
_space_group_IT_number           228
_symmetry_space_group_name_Hall  '-F 4ud 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   21.136
_cell_length_b                   21.136
_cell_length_c                   21.136
_cell_volume                     9442.096
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Jaussaud_SSSCFJ_2003_1058.cif
_cod_data_source_block           Si17.48Te9.52
_cod_database_code               1536089
Solid state polymerization of S2 N2 to (SN)x
Cohen, M.J.; Mikulski, C.M.; Garito, A.F.; Heeger, A.J.; MacDiarmid, A.G.; Saran, M.S.; Kleppinger, J.; Journal of the American Chemical Society 98 (1976) 3844–3848; doi:

data_4124641
_publ_section_title
;
 Solid state polymerization of S2 N2 to (SN)x
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              3844
_journal_page_last               3848
_journal_volume                  98
_journal_year                    1976
_chemical_formula_sum            'N2 S2'
_chemical_name_systematic        'S2 N2'
_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                 106.43
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.485
_cell_length_b                   3.767
_cell_length_c                   8.452
_cell_volume                     136.966
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Cohen_JACSAT_1976_356.cif
_cod_data_source_block           N2S2
_cod_original_cell_volume        136.9655
_cod_database_code               4124641
Variations of the Fe Ga3 structure type in the systems Co In3-x Znx and Co Ga3-x Znx.
Viklund, P.; Lidin, S.; Berastegui, P.; Haeussermann, U.; Journal of Solid State Chemistry 164 (2002) 100–110; doi:

data_1536090
_publ_section_title
;
 Variations of the Fe Ga3 structure type in the systems Co In3-x Znx and
 Co Ga3-x Znx.
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              100
_journal_page_last               110
_journal_volume                  164
_journal_year                    2002
_chemical_formula_sum            'Co4 Ga11.04 Zn0.96'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   6.2772
_cell_length_b                   6.2772
_cell_length_c                   6.353
_cell_volume                     250.329
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Viklund_JSSCBI_2002_357.cif
_cod_data_source_block           Co4Ga11.04Zn0.96
_cod_original_cell_volume        250.3288
_cod_database_code               1536090
High pressure synthesis and crystal structure of two forms of a new tellurium-silicon clathrate related to the classical type I
Jaussaud, N.; Toulemonde, P.; Pechev, S.; Pouchard, M.; Gravereau, P.; San Miguel, A.; Goglio, G.; Cros, C.; Solid State Sciences 6 (2004) 401–411; doi:

data_1536091
_publ_section_title
;
 High pressure synthesis and crystal structure of two forms of a new
 tellurium-silicon clathrate related to the classical type I
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              401
_journal_page_last               411
_journal_volume                  6
_journal_year                    2004
_chemical_formula_sum            'Si38 Te16'
_chemical_name_systematic        'Te16 Si38'
_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                   10.457
_cell_length_b                   10.457
_cell_length_c                   10.457
_cell_volume                     1143.461
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Jaussaud_SSSCFJ_2004_1396.cif
_cod_data_source_block           Si38Te16
_cod_database_code               1536091
Neutron diffraction studies of Ni Co P4 O12 and Ni Zn P4 O12
Nord, A.G.; Materials Research Bulletin 18 (1983) 765–773; doi:

data_1536092
_publ_section_title
;
 Neutron diffraction studies of Ni Co P4 O12 and Ni Zn P4 O12
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              765
_journal_page_last               773
_journal_volume                  18
_journal_year                    1983
_chemical_formula_sum            'Co Ni O12 P4'
_chemical_name_systematic        'Ni Co (P4 O12)'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 118.55
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.718
_cell_length_b                   8.267
_cell_length_c                   9.871
_cell_volume                     839.953
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Nord_MRBUAC_1983_219.cif
_cod_data_source_block           Co1Ni1O12P4
_cod_original_cell_volume        839.9532
_cod_original_formula_sum        'Co1 Ni1 O12 P4'
_cod_database_code               1536092
Formation of Nitride Clusters by the Action of N O(+) on (M4 H3 (C O)12)(-) (M= Ru, Os): the Synthesis and Structural Characterization of (Ru4(mue-H)3(C O)11 (mue 4-N)) and (N(P Ph3)2)(Os4(C O)12(mue 4-N))
Collins, M.A.; McPartlin, M.; Johnson, B.F.G.; Lewis, J.; Raithby, P.R.; Morris, J.; Mace, J.M.; Nelson, W.J.H.; Puga, J.; Journal of the Chemical Society. Chemical Communications (1972-) 1983 (1983) 689–691; doi:

data_7117907
_publ_section_title
;
 Formation of Nitride Clusters by the Action of N O(+) on (M4 H3 (C
 O)12)(-) (M= Ru, Os): the Synthesis and Structural Characterization of
 (Ru4(mue-H)3(C O)11 (mue 4-N)) and (N(P Ph3)2)(Os4(C O)12(mue 4-N))
;
_journal_name_full
;
Journal of the Chemical Society. Chemical Communications (1972-)
;
_journal_page_first              689
_journal_page_last               691
_journal_volume                  1983
_journal_year                    1983
_chemical_formula_sum            'C11 H3 N O11 Ru4'
_chemical_name_systematic        '(Ru4 (H3) (C O)11 (N))'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                91.39
_cell_angle_beta                 96.23
_cell_angle_gamma                90.59
_cell_formula_units_Z            4
_cell_length_a                   9.554
_cell_length_b                   12.743
_cell_length_c                   16.012
_cell_volume                     1937.160
_citation_journal_id_ASTM        JCCCAT
_cod_data_source_file            Collins_JCCCAT_1983_304.cif
_cod_data_source_block           C11H3N1O11Ru4
_cod_original_cell_volume        1937.16
_cod_original_formula_sum        'C11 H3 N1 O11 Ru4'
_cod_database_code               7117907
A high-yield synthesis of Ru5 C (C O)15 by the carbonylation of Ru6 C (C O)17; the x-ray structure analyses of Ru5 C (C O)15 and Ru5 C (C O)14 P Ph3
Farrar, D.H.; McPartlin, M.; Johnson, B.F.G.; Lewis, J.; Nicholls, J.N.; Jackson, P.F.; Journal of the Chemical Society. Chemical Communications (1972-) 1981 (1981) 415–416; doi:

data_7117908
_publ_section_title
;
 A high-yield synthesis of Ru5 C (C O)15 by the carbonylation of Ru6 C (C
 O)17; the x-ray structure analyses of Ru5 C (C O)15 and Ru5 C (C O)14 P
 Ph3
;
_journal_name_full
;
Journal of the Chemical Society. Chemical Communications (1972-)
;
_journal_page_first              415
_journal_page_last               416
_journal_volume                  1981
_journal_year                    1981
_chemical_formula_sum            'C16 O15 Ru5'
_chemical_name_systematic        'C (Ru (C O)3)5'
_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                 91.358
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   16.448
_cell_length_b                   14.274
_cell_length_c                   20.834
_cell_volume                     4890.007
_citation_journal_id_ASTM        JCCCAT
_cod_data_source_file            Farrar_JCCCAT_1981_1332.cif
_cod_data_source_block           C16O15Ru5
_cod_database_code               7117908
Variations of the Fe Ga3 structure type in the systems Co In3-x Znx and Co Ga3-x Znx.
Viklund, P.; Lidin, S.; Journal of Solid State Chemistry 165 (2002) 100–110; doi:

data_1536093
_publ_section_title
;
 Variations of the Fe Ga3 structure type in the systems Co In3-x Znx and
 Co Ga3-x Znx.
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              100
_journal_page_last               110
_journal_volume                  165
_journal_year                    2002
_chemical_formula_sum            'Co4 In9.08 Zn2.92'
_space_group_IT_number           84
_symmetry_space_group_name_Hall  '-P 4c'
_symmetry_space_group_name_H-M   'P 42/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   6.6975
_cell_length_b                   6.6975
_cell_length_c                   6.996
_cell_volume                     313.816
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Viklund_JSSCBI_2002_358.cif
_cod_data_source_block           Co4In9.08Zn2.92
_cod_original_cell_volume        313.8161
_cod_database_code               1536093
Neutron diffraction studies of Ni Co P4 O12 and Ni Zn P4 O12
Nord, A.G.; Materials Research Bulletin 18 (1983) 765–773; doi:

data_1536094
_publ_section_title
;
 Neutron diffraction studies of Ni Co P4 O12 and Ni Zn P4 O12
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              765
_journal_page_last               773
_journal_volume                  18
_journal_year                    1983
_chemical_formula_sum            'Ni O12 P4 Zn'
_chemical_name_systematic        'Ni Zn (P4 O12)'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 118.55
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.689
_cell_length_b                   8.277
_cell_length_c                   9.87
_cell_volume                     838.803
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Nord_MRBUAC_1983_220.cif
_cod_data_source_block           Ni1O12P4Zn1
_cod_original_formula_sum        'Ni1 O12 P4 Zn1'
_cod_database_code               1536094
Ta97 Te60: a crystalline approximant of a tantalum telluride quasicrystal with twelvefold rotational symmetry
Conrad, M.; Harbrecht, B.; Chemistry - A European Journal 8 (2000) 3094–3102; doi:

data_1536095
_publ_section_title
;
 Ta97 Te60: a crystalline approximant of a tantalum telluride quasicrystal
 with twelvefold rotational symmetry
;
_journal_name_full               'Chemistry - A European Journal'
_journal_page_first              3094
_journal_page_last               3102
_journal_volume                  8
_journal_year                    2000
_chemical_formula_sum            'Ta97 Te60'
_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            4
_cell_length_a                   27.627
_cell_length_b                   27.627
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