LMucko/crystallography-open-database huggingface dataset:
Synthesis and crystal structure of BaTiOF~4~
Crosnier, M P; Fourquet, J L; European Journal of Solid State Inorganic Chemistry 29 (1992) 199–206; doi:

data_1000332
_publ_section_title
;
Synthesis and crystal structure of BaTiOF~4~
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              199
_journal_page_last               206
_journal_volume                  29
_journal_year                    1992
_chemical_formula_structural     'Ba (Ti O F4)'
_chemical_formula_sum            'Ba F4 O Ti'
_chemical_name_systematic        'Barium oxotetrafluorotitanate'
_space_group_IT_number           57
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      57
_symmetry_space_group_name_Hall  '-P 2c 2b'
_symmetry_space_group_name_H-M   'P b c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.1719(2)
_cell_length_b                   13.7555(7)
_cell_length_c                   5.5178(2)
_cell_volume                     392.5
_refine_ls_R_factor_all          0.026
_cod_database_code               1000332
Crystal structure of Li~2~PdP~2~O~7~ solved from X-ray powder diffraction
Laligant, Y; European Journal of Solid State Inorganic Chemistry 29 (1992) 239–247; doi:

data_1000333
_publ_section_title
;
Crystal structure of Li~2~PdP~2~O~7~ solved from X-ray powder
diffraction
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              239
_journal_page_last               247
_journal_volume                  29
_journal_year                    1992
_chemical_formula_structural     'Li2 Pd (P2 O7)'
_chemical_formula_sum            'Li2 O7 P2 Pd'
_chemical_name_systematic        'Dilithium palladium diphosphate'
_space_group_IT_number           74
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      74
_symmetry_space_group_name_Hall  '-I 2b 2'
_symmetry_space_group_name_H-M   'I m m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.5858(9)
_cell_length_b                   7.4955(5)
_cell_length_c                   5.8116(4)
_cell_volume                     548.2
_refine_ls_R_factor_all          0.051
_cod_database_code               1000333
Li^+^-H^+^ exchange on Li~2~TiTeO~6~
Crosnier, M P; Delarue, E; Choisnet, J; Fourquet, J L; European Journal of Solid State Inorganic Chemistry 39 (1992) 321–332; doi:

data_1000334
_publ_section_title              'Li^+^-H^+^ exchange on Li~2~TiTeO~6~'
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              321
_journal_page_last               332
_journal_volume                  39
_journal_year                    1992
_chemical_formula_structural     'Li2 (Ti Te) O6'
_chemical_formula_sum            'Li2 O6 Te Ti'
_chemical_name_systematic        'Dilithium titanium tellurium oxide'
_space_group_IT_number           34
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      34
_symmetry_space_group_name_Hall  'P 2 -2n'
_symmetry_space_group_name_H-M   'P n n 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.0743(2)
_cell_length_b                   4.9067(2)
_cell_length_c                   8.4083(4)
_cell_volume                     209.4
_refine_ls_R_factor_all          0.027
_cod_database_code               1000334
Li^+^-H^+^ exchange on Li~2~TiTeO~6~
Crosnier, M P; Delarue, E; Choisnet, J; Fourquet, J L; European Journal of Solid State Inorganic Chemistry 39 (1992) 321–332; doi:

data_1000335
_publ_section_title              'Li^+^-H^+^ exchange on Li~2~TiTeO~6~'
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              321
_journal_page_last               332
_journal_volume                  39
_journal_year                    1992
_chemical_formula_structural     '(Li0.32 H1.68) Ti Te O6'
_chemical_formula_sum            'H1.68 Li0.32 O6 Te Ti'
_chemical_name_systematic
;
Lithium hydrogen titanium tellurium oxide (.3/1.7/1/1/6)
;
_space_group_IT_number           58
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            2
_cell_length_a                   5.0098(5)
_cell_length_b                   4.7020(3)
_cell_length_c                   8.6118(6)
_cell_volume                     202.9
_refine_ls_R_factor_all          0.026
_cod_original_formula_sum        'H1.68 Li.32 O6 Te Ti'
_cod_database_code               1000335
Li^+^-H^+^ exchange on Li~2~TiTeO~6~
Crosnier, M P; Delarue, E; Choisnet, J; Fourquet, J L; European Journal of Solid State Inorganic Chemistry 39 (1992) 321–332; doi:

data_1000336
_publ_section_title              'Li^+^-H^+^ exchange on Li~2~TiTeO~6~'
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              321
_journal_page_last               332
_journal_volume                  39
_journal_year                    1992
_chemical_formula_structural     '(Li0.32 H1.68) (Ti Te) O6'
_chemical_formula_sum            'H1.68 Li0.32 O6 Te Ti'
_chemical_name_systematic
;
Lithium hydrogen titanium tellurium (.3/1.7/1/1/6)
;
_space_group_IT_number           102
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      102
_symmetry_space_group_name_Hall  'P 4n -2n'
_symmetry_space_group_name_H-M   'P 42 n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.6861(1)
_cell_length_b                   4.6861(1)
_cell_length_c                   8.8707(3)
_cell_volume                     194.8
_refine_ls_R_factor_all          0.026
_cod_original_formula_sum        'H1.68 Li.32 O6 Te Ti'
_cod_database_code               1000336
Structure determination of Na~2~PdP~2~O~7~ from X-ray powder diffraction
Laligant, Y; European Journal of Solid State Inorganic Chemistry 29 (1992) 83–94; doi:

data_1000337
_publ_section_title
;
Structure determination of Na~2~PdP~2~O~7~ from X-ray powder diffraction
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              83
_journal_page_last               94
_journal_volume                  29
_journal_year                    1992
_chemical_formula_structural     'Na2 Pd (P2 O7)'
_chemical_formula_sum            'Na2 O7 P2 Pd'
_chemical_name_systematic        'Disodium palladium diphosphate'
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 114.11(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   14.693(3)
_cell_length_b                   5.8551(4)
_cell_length_c                   7.922(2)
_cell_volume                     622.1
_refine_ls_R_factor_all          0.02
_cod_database_code               1000337
Structure of Na~2~ Ba~3~ Cr~4~ F~20~
Abjean, P; Leblanc, M; De, Pape R; Ferey, G; Acta Crystallographica C (39,1983-) 41 (1985) 1696–1698; doi:

data_1000338
_publ_section_title              'Structure of Na~2~ Ba~3~ Cr~4~ F~20~'
_journal_coden_ASTM              ACSCEE
_journal_name_full               'Acta Crystallographica C (39,1983-)'
_journal_page_first              1696
_journal_page_last               1698
_journal_volume                  41
_journal_year                    1985
_chemical_formula_structural     'Na2 Ba3 Cr4 F20'
_chemical_formula_sum            'Ba3 Cr4 F20 Na2'
_chemical_name_systematic        'Disodium tribarium tetrachromium fluoride'
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 90.76(1)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.262(4)
_cell_length_b                   20.668(8)
_cell_length_c                   5.431(2)
_cell_volume                     815.1
_exptl_crystal_density_meas      4.26
_refine_ls_R_factor_all          0.027
_cod_database_code               1000338
The potassium niobyl cyclotetrasilicate K~2~(NbO)~2~Si~4~O~12~
Crosnier, M P; Guyomard, D; Verbaere, A; Piffard, Y; Tournoux, M; Journal of Solid State Chemistry 98 (1992) 128–132; doi:10.1016/0022-4596(92)90077-9

data_1000339
_publ_section_title
;
The potassium niobyl cyclotetrasilicate K~2~(NbO)~2~Si~4~O~12~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              128
_journal_page_last               132
_journal_paper_doi               10.1016/0022-4596(92)90077-9
_journal_volume                  98
_journal_year                    1992
_chemical_formula_structural     'K2 (Nb O)2 (Si4 O12)'
_chemical_formula_sum            'K2 Nb2 O14 Si4'
_chemical_name_systematic
;
Dipotassium bis(oxoniobium) cyclo-tetrasilicate
;
_space_group_IT_number           100
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      100
_symmetry_space_group_name_Hall  'P 4 -2ab'
_symmetry_space_group_name_H-M   'P 4 b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.7404(8)
_cell_length_b                   8.7404(8)
_cell_length_c                   8.136(1)
_cell_volume                     621.5
_refine_ls_R_factor_all          0.021
_cod_database_code               1000339
New pentamers of octahedra: structural and magnetic characterization of Na~3~Sr~4~Cr~5~F~26~
Hemon, A; Courbion, G; Journal of Solid State Chemistry 98 (1992) 358–365; doi:10.1016/S0022-4596(05)80246-4

data_1000340
_publ_section_title
;
New pentamers of octahedra: structural and magnetic characterization of
Na~3~Sr~4~Cr~5~F~26~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              358
_journal_page_last               365
_journal_paper_doi               10.1016/S0022-4596(05)80246-4
_journal_volume                  98
_journal_year                    1992
_chemical_formula_structural     'Na3 Sr4 (Cr5 F26)'
_chemical_formula_sum            'Cr5 F26 Na3 Sr4'
_chemical_name_systematic
;
Trisodium tetrastrontium fluoropentachromate(III)
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 111.244(9)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   19.959(2)
_cell_length_b                   7.450(1)
_cell_length_c                   29.291(6)
_cell_volume                     4059.4
_refine_ls_R_factor_all          0.034
_cod_database_code               1000340
Synthesis and crystal structure of a new acentric oxyfluoride: Ba~2~TiOF~6~
Crosnier, M P; Fourquet, J L; Journal of Solid State Chemistry 99 (1992) 355–363; doi:10.1016/0022-4596(92)90324-O

data_1000341
_publ_section_title
;
Synthesis and crystal structure of a new acentric oxyfluoride:
Ba~2~TiOF~6~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              355
_journal_page_last               363
_journal_paper_doi               10.1016/0022-4596(92)90324-O
_journal_volume                  99
_journal_year                    1992
_chemical_formula_structural     'Ba2 (Ti O F6)'
_chemical_formula_sum            'Ba2 F6 O Ti'
_chemical_name_systematic        'Barium hexafluorooxotitanate'
_space_group_IT_number           9
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      9
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 126.67(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.446(2)
_cell_length_b                   9.304(2)
_cell_length_c                   7.252(2)
_cell_volume                     619.4
_refine_ls_R_factor_all          0.018
_cod_database_code               1000341
BaNbF~7-x~(OH)~x~: preparation and crystal structure
Crosnier-Lopez, M P; Duroy, H; Fourquet, J L; European Journal of Solid State Inorganic Chemistry 30 (1993) 549–556; doi:

data_1000342
_publ_section_title
;
BaNbF~7-x~(OH)~x~: preparation and crystal structure
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              549
_journal_page_last               556
_journal_volume                  30
_journal_year                    1993
_chemical_formula_structural     'Ba Nb (F5.5 (O H)1.5)'
_chemical_formula_sum            'Ba F5.5 H1.5 Nb O1.5'
_chemical_name_systematic
;
Barium niobium fluoride hydroxide (1/1/5.5/1.5)
;
_space_group_IT_number           205
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      205
_symmetry_space_group_name_Hall  '-P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P a -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.9259(5)
_cell_length_b                   9.9259(5)
_cell_length_c                   9.9259(5)
_cell_volume                     977.9
_refine_ls_R_factor_all          0.02
_cod_original_formula_sum        'H1.5 Ba F5.5 Nb O1.5'
_cod_database_code               1000342
Growth, structure, NMR characterization of a new fluorocarbonate Na~3~La~2~(CO~3~)~4~F
Mercier, N; Taulelle, F; Leblanc, M; European Journal of Solid State Inorganic Chemistry 30 (1993) 609–617; doi:

data_1000343
_publ_section_title
;
Growth, structure, NMR characterization of a new fluorocarbonate
Na~3~La~2~(CO~3~)~4~F
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              609
_journal_page_last               617
_journal_volume                  30
_journal_year                    1993
_chemical_formula_structural     'Na3 La2 (C O3)4 F'
_chemical_formula_sum            'C4 F La2 Na3 O12'
_chemical_name_systematic
;
Trisodium dilanthanum tetracarbonate fluoride
;
_space_group_IT_number           194
_symmetry_cell_setting           hexagonal
_symmetry_Int_Tables_number      194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   5.083(1)
_cell_length_b                   5.083(1)
_cell_length_c                   23.034(5)
_cell_volume                     515.4
_refine_ls_R_factor_all          0.021
_cod_original_formula_sum        'F La2 Na3 O12'
_cod_database_code               1000343
On the first palladium chromate: crystal structure of Pd(NH~3~)~4~(CrO~4~)
Laligant, Y; European Journal of Solid State Inorganic Chemistry 30 (1993) 681–688; doi:

data_1000344
_publ_section_title
;
On the first palladium chromate: crystal structure of
Pd(NH~3~)~4~(CrO~4~)
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              681
_journal_page_last               688
_journal_volume                  30
_journal_year                    1993
_chemical_formula_structural     '(Pd (N H3)4) (Cr O4)'
_chemical_formula_sum            'Cr H12 N4 O4 Pd'
_chemical_name_systematic        'Tetraamminepalladium chromate'
_space_group_IT_number           141
_symmetry_cell_setting           tetragonal
_symmetry_space_group_name_Hall  '-I 4bd 2'
_symmetry_space_group_name_H-M   'I 41/a m d :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.3177(11)
_cell_length_b                   7.3177(11)
_cell_length_c                   15.289(3)
_cell_volume                     818.7
_refine_ls_R_factor_all          0.03
_cod_original_sg_symbol_H-M      'I 41/a m d Z'
_cod_original_formula_sum        'H12 Cr N4 O4 Pd'
_cod_database_code               1000344
Ba~3~V~2~O~4~F~8~:(V~4~(O,F)~20~)^8-^ tetrameric groups of octahedra inserted in a tridimensional network of (FBa~4~) tetrahedra
Crosnier-Lopez, M P; Duroy, H; Fourquet, J L; Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 1597–1602; doi:10.1002/zaac.19936190915

data_1000345
_publ_section_title
;
Ba~3~V~2~O~4~F~8~:(V~4~(O,F)~20~)^8-^ tetrameric groups of octahedra
inserted in a tridimensional network of (FBa~4~) tetrahedra
;
_journal_coden_ASTM              ZAACAB
_journal_name_full
;
Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_page_first              1597
_journal_page_last               1602
_journal_paper_doi               10.1002/zaac.19936190915
_journal_volume                  619
_journal_year                    1993
_chemical_formula_structural     'Ba3 (V2 O4 F8)'
_chemical_formula_sum            'Ba3 F8 O4 V2'
_chemical_name_systematic        'Barium tetraoxooctafluorodivanadate'
_space_group_IT_number           58
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   9.945(4)
_cell_length_b                   10.277(1)
_cell_length_c                   9.673(1)
_cell_volume                     988.6
_refine_ls_R_factor_all          0.033
_cod_database_code               1000345
$-beta-Cu~3~Fe~4~(VO~4~)~6~: Structural study and relationships; physical properties
Lafontaine, M A; Greneche, J M; Laligant, Y; Ferey, G; Journal of Solid State Chemistry 108 (1994) 1–10; doi:10.1006/jssc.1994.1001

data_1000346
_publ_section_title
;
$-beta-Cu~3~Fe~4~(VO~4~)~6~: Structural study and relationships;
physical properties
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1
_journal_page_last               10
_journal_paper_doi               10.1006/jssc.1994.1001
_journal_volume                  108
_journal_year                    1994
_chemical_formula_structural     'Cu3 Fe4 (V O4)6'
_chemical_formula_sum            'Cu3 Fe4 O24 V6'
_chemical_name_systematic
;
Tricopper tetrairon(III) hexakis(vanadate) - $-beta
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                106.08(3)
_cell_angle_beta                 103.72(3)
_cell_angle_gamma                102.28(2)
_cell_formula_units_Z            1
_cell_length_a                   6.600(3)
_cell_length_b                   8.048(4)
_cell_length_c                   9.759(5)
_cell_volume                     461.9
_refine_ls_R_factor_all          0.041
_cod_database_code               1000346
Passage from T-type to T'-type arrangement by reducing R~4~Ni~3~O~10~ to R~4~Ni~3~O~8~ (R=La, Pr, Nd)
Lacorre, Ph; Journal of Solid State Chemistry 97 (1992) 495–500; doi:10.1016/0022-4596(92)90061-Y

data_1000347
_publ_section_title
;
Passage from T-type to T'-type arrangement by reducing R~4~Ni~3~O~10~
to R~4~Ni~3~O~8~ (R=La, Pr, Nd)
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              495
_journal_page_last               500
_journal_paper_doi               10.1016/0022-4596(92)90061-Y
_journal_volume                  97
_journal_year                    1992
_chemical_formula_structural     'Nd4 Ni3 O8'
_chemical_formula_sum            'Nd4 Ni3 O8'
_chemical_name_systematic        'Neodymium nickel oxide (4/3/8)'
_space_group_IT_number           139
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.9171(1)
_cell_length_b                   3.9171(1)
_cell_length_c                   25.307(1)
_cell_volume                     388.3
_refine_ls_R_factor_all          0.027
_cod_database_code               1000347
A new refinement of the crystal structure of MnAlF~5~: new structural correlations with MnCrF~5~ and Cr~2~F~5~ using orthogonal subcell twinning
Ferey, G; Leblanc, M; Mercier, A - M; Journal of Solid State Chemistry 102 (1993) 9–19; doi:10.1006/jssc.1993.1003

data_1000348
_publ_section_title
;
A new refinement of the crystal structure of MnAlF~5~: new structural
correlations with MnCrF~5~ and Cr~2~F~5~ using orthogonal subcell
twinning
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              9
_journal_page_last               19
_journal_paper_doi               10.1006/jssc.1993.1003
_journal_volume                  102
_journal_year                    1993
_chemical_formula_structural     'Mn Al F5'
_chemical_formula_sum            'Al F5 Mn'
_chemical_name_systematic        'Manganese aluminium fluoride'
_space_group_IT_number           63
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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                   3.5837(4)
_cell_length_b                   9.854(1)
_cell_length_c                   9.537(1)
_cell_volume                     336.8
_exptl_crystal_density_meas      3.52
_refine_ls_R_factor_all          0.023
_cod_database_code               1000348