LMucko/crystallography-open-database huggingface dataset:
Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M.; Journal of the American Chemical Society  (2014) 141121132150009–; doi:10.1021/ja509907r

data_4123006
_publ_section_title
;
 Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              141121132150009
_journal_paper_doi               10.1021/ja509907r
_journal_year                    2014
_chemical_formula_sum            'As2 Ba0.84 Fe2 K0.16'
_chemical_formula_weight         383.2
_chemical_name_common            'Barium Potassium Iron Arsenide'
_space_group_IT_number           139
_symmetry_cell_setting           tetragonal
_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                   3.94518(10)
_cell_length_b                   3.94518(10)
_cell_length_c                   13.13219(10)
_cell_measurement_temperature    293
_cell_volume                     204.395(7)
_computing_publication_material  '(Jana2000; Petricek and Dusek, 2000)'
_computing_structure_refinement  '(Jana2000; Petricek and Dusek, 2000)'
_diffrn_ambient_temperature      293
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.41383
_exptl_absorpt_coefficient_mu    6.993
_exptl_absorpt_process_details
'(Jana2000; Petricek, Dusek & Palatinus, 2000)'
_exptl_crystal_density_diffrn    6.2237
_exptl_crystal_F_000             336
_pd_meas_2theta_range_inc        0.001
_pd_meas_2theta_range_max        49.989
_pd_meas_2theta_range_min        0.500
_pd_meas_number_of_points        49496
_pd_proc_2theta_range_inc        0.001
_pd_proc_2theta_range_max        49.989
_pd_proc_2theta_range_min        0.5
_pd_proc_ls_background_function  '14 Chebyshev polynoms'
_pd_proc_ls_pref_orient_corr     'March & Dollase'
_pd_proc_ls_profile_function     Pseudo-Voigt
_pd_proc_ls_prof_R_factor        0.1013
_pd_proc_ls_prof_wR_expected     0.0713
_pd_proc_ls_prof_wR_factor       0.1332
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   3.49
_refine_ls_number_parameters     40
_refine_ls_R_factor_all          0.0438
_refine_ls_R_factor_gt           0.0437
_refine_ls_shift/su_max          0.0176
_refine_ls_shift/su_mean         0.0025
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_gt          0.0380
_refine_ls_wR_factor_ref         0.0380
_cod_data_source_file            ja509907r_si_011.cif
_cod_data_source_block           (I)
_cod_database_code               4123006
Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M.; Journal of the American Chemical Society  (2014) 141121132150009–; doi:10.1021/ja509907r

data_4123007
_publ_section_title
;
 Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              141121132150009
_journal_paper_doi               10.1021/ja509907r
_journal_year                    2014
_chemical_formula_sum            'As2 Ba0.52 Fe2 K0.48'
_chemical_formula_weight         351.7
_chemical_name_common            'Barium Potassium Iron Arsenide'
_chemical_name_systematic        ' ?'
_space_group_IT_number           139
_symmetry_cell_setting           tetragonal
_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                   3.90675(10)
_cell_length_b                   3.90675(10)
_cell_length_c                   13.37425(10)
_cell_measurement_temperature    293
_cell_volume                     204.127(8)
_computing_publication_material  '(Jana2000; Petricek and Dusek, 2000)'
_computing_structure_refinement  '(Jana2000; Petricek and Dusek, 2000)'
_diffrn_ambient_temperature      293
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.41383
_exptl_absorpt_coefficient_mu    6.359
_exptl_absorpt_process_details
'(Jana2000; Petricek, Dusek & Palatinus, 2000)'
_exptl_crystal_density_diffrn    5.7205
_exptl_crystal_F_000             313
_pd_meas_2theta_range_inc        0.001
_pd_meas_2theta_range_max        49.989
_pd_meas_2theta_range_min        0.500
_pd_meas_number_of_points        49496
_pd_proc_2theta_range_inc        0.001
_pd_proc_2theta_range_max        49.989
_pd_proc_2theta_range_min        0.5
_pd_proc_ls_background_function  '14 Chebyshev polynoms'
_pd_proc_ls_pref_orient_corr     'March & Dollase'
_pd_proc_ls_profile_function     Pseudo-Voigt
_pd_proc_ls_prof_R_factor        0.0974
_pd_proc_ls_prof_wR_expected     0.0815
_pd_proc_ls_prof_wR_factor       0.1306
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   2.6
_refine_ls_number_parameters     27
_refine_ls_R_factor_all          0.0708
_refine_ls_R_factor_gt           0.0634
_refine_ls_shift/su_max          0.0225
_refine_ls_shift/su_mean         0.0014
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_gt          0.0425
_refine_ls_wR_factor_ref         0.0426
_cod_data_source_file            ja509907r_si_010.cif
_cod_data_source_block           (I)
_cod_database_code               4123007
Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M.; Journal of the American Chemical Society  (2014) 141121132150009–; doi:10.1021/ja509907r

data_4123008
_publ_section_title
;
 Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              141121132150009
_journal_paper_doi               10.1021/ja509907r
_journal_year                    2014
_chemical_formula_sum            'As2 Fe2 K'
_chemical_formula_weight         300.6
_chemical_name_common            'Potassium Iron Arsenide'
_chemical_name_systematic        ' ?'
_space_group_IT_number           139
_symmetry_cell_setting           tetragonal
_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                   3.849(2)
_cell_length_b                   3.849(2)
_cell_length_c                   13.867(3)
_cell_measurement_temperature    293
_cell_volume                     205.44(16)
_computing_publication_material  '(Jana2000; Petricek and Dusek, 2000)'
_computing_structure_refinement  '(Jana2000; Petricek and Dusek, 2000)'
_diffrn_ambient_temperature      293
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.41383
_exptl_absorpt_coefficient_mu    5.282
_exptl_absorpt_process_details
'(Jana2000; Petricek, Dusek & Palatinus, 2000)'
_exptl_crystal_density_diffrn    4.860
_exptl_crystal_F_000             266
_pd_meas_2theta_range_inc        0.001
_pd_meas_2theta_range_max        49.989
_pd_meas_2theta_range_min        0.500
_pd_meas_number_of_points        49496
_pd_proc_2theta_range_inc        0.001
_pd_proc_2theta_range_max        49.989
_pd_proc_2theta_range_min        2.001
_pd_proc_ls_background_function  '26 Chebyshev polynoms'
_pd_proc_ls_pref_orient_corr     'March & Dollase'
_pd_proc_ls_profile_function     Pseudo-Voigt
_pd_proc_ls_prof_R_factor        0.0890
_pd_proc_ls_prof_wR_expected     0.0935
_pd_proc_ls_prof_wR_factor       0.1240
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.76
_refine_ls_number_parameters     38
_refine_ls_R_factor_all          0.1171
_refine_ls_R_factor_gt           0.0830
_refine_ls_shift/su_max          0.1038
_refine_ls_shift/su_mean         0.0101
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_gt          0.0600
_refine_ls_wR_factor_ref         0.0610
_cod_data_source_file            ja509907r_si_006.cif
_cod_data_source_block           (I)
_cod_original_cell_volume        205.38(16)
_cod_original_formula_sum        'As2 Fe2 K1'
_cod_database_code               4123008
Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M.; Journal of the American Chemical Society  (2014) 141121132150009–; doi:10.1021/ja509907r

data_4123009
_publ_section_title
;
 Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              141121132150009
_journal_paper_doi               10.1021/ja509907r
_journal_year                    2014
_chemical_formula_sum            'As2 Ba Fe2'
_chemical_formula_weight         398.9
_chemical_name_common            'Barium Iron Arsenide'
_space_group_IT_number           69
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-F 2 2'
_symmetry_space_group_name_H-M   'F m m m'
_audit_creation_method           'Jana2000 Version : 09/02/2006'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.6139(1)
_cell_length_b                   5.5746(1)
_cell_length_c                   12.9594(3)
_cell_measurement_temperature    100
_cell_volume                     405.568(14)
_computing_publication_material  '(Jana2000; Petricek and Dusek, 2000)'
_computing_structure_refinement  '(Jana2000; Petricek and Dusek, 2000)'
_diffrn_ambient_temperature      100
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.41383
_exptl_absorpt_coefficient_mu    7.372
_exptl_absorpt_process_details
'(Jana2000; Petricek, Dusek & Palatinus, 2000)'
_exptl_crystal_density_diffrn    6.5304
_exptl_crystal_F_000             696
_pd_meas_2theta_range_inc        0.001
_pd_meas_2theta_range_max        49.989
_pd_meas_2theta_range_min        0.500
_pd_meas_number_of_points        49496
_pd_proc_2theta_range_inc        0.001
_pd_proc_2theta_range_max        49.989
_pd_proc_2theta_range_min        0.5
_pd_proc_ls_background_function  '20 Chebyshev polynoms'
_pd_proc_ls_pref_orient_corr     'March & Dollase'
_pd_proc_ls_profile_function     Pseudo-Voigt
_pd_proc_ls_prof_R_factor        0.0869
_pd_proc_ls_prof_wR_expected     0.0900
_pd_proc_ls_prof_wR_factor       0.1214
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.82
_refine_ls_number_parameters     37
_refine_ls_R_factor_all          0.0336
_refine_ls_R_factor_gt           0.0336
_refine_ls_shift/su_max          0.0229
_refine_ls_shift/su_mean         0.0016
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_gt          0.0280
_refine_ls_wR_factor_ref         0.0280
_cod_data_source_file            ja509907r_si_008.cif
_cod_data_source_block           global
_cod_original_cell_volume        405.571(1)
_cod_original_formula_sum        'As2 Ba1 Fe2'
_cod_database_code               4123009
Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
Zaikina, Julia V.; Batuk, Maria; Abakumov, Artem M.; Navrotsky, Alexandra; Kauzlarich, Susan M.; Journal of the American Chemical Society  (2014) 141121132150009–; doi:10.1021/ja509907r

data_4123010
_publ_section_title
;
 Facile Synthesis of Ba1-xKxFe2As2 Superconductors via Hydride Route.
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              141121132150009
_journal_paper_doi               10.1021/ja509907r
_journal_year                    2014
_chemical_formula_sum            'As2 Ba0.84 Fe2 K0.16'
_chemical_formula_weight         383.2
_chemical_name_common            'Barium Potassium Iron Arsenide'
_space_group_IT_number           69
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-F 2 2'
_symmetry_space_group_name_H-M   'F m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.5864(2)
_cell_length_b                   5.5564(2)
_cell_length_c                   13.061(6)
_cell_measurement_temperature    100
_cell_volume                     405.42(19)
_computing_publication_material  '(Jana2000; Petricek and Dusek, 2000)'
_computing_structure_refinement  '(Jana2000; Petricek and Dusek, 2000)'
_diffrn_ambient_temperature      100
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.41383
_exptl_absorpt_coefficient_mu    7.051
_exptl_absorpt_process_details
'(Jana2000; Petricek, Dusek & Palatinus, 2000)'
_exptl_crystal_density_diffrn    6.2755
_exptl_crystal_F_000             672
_pd_meas_2theta_range_inc        0.001
_pd_meas_2theta_range_max        49.989
_pd_meas_2theta_range_min        0.500
_pd_meas_number_of_points        49496
_pd_proc_2theta_range_inc        0.001
_pd_proc_2theta_range_max        49.989
_pd_proc_2theta_range_min        0.5
_pd_proc_ls_background_function  '16 Chebyshev polynoms'
_pd_proc_ls_pref_orient_corr     'March & Dollase'
_pd_proc_ls_profile_function     Pseudo-Voigt
_pd_proc_ls_prof_R_factor        0.0932
_pd_proc_ls_prof_wR_expected     0.0902
_pd_proc_ls_prof_wR_factor       0.1264
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.97
_refine_ls_number_parameters     40
_refine_ls_R_factor_all          0.0369
_refine_ls_R_factor_gt           0.0369
_refine_ls_shift/su_max          0.0142
_refine_ls_shift/su_mean         0.0020
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_gt          0.0370
_refine_ls_wR_factor_ref         0.0370
_cod_data_source_file            ja509907r_si_012.cif
_cod_data_source_block           (I)
_cod_original_cell_volume        405.41(4)
_cod_database_code               4123010
Synthesis and study on structure of tetramolybdenum (V) complex [Mo4(mu3-O)2O4Cl2(p-OCOC6H4CH3)6].2C6H5Cl
Chunting, Sun; Chunxiao, Guo; Yan, Jiang; Tiejin, Li; Ling, Ye; Yuguo, Fan; European Journal of Solid State and Inorganic Chemistry 26 (1989) 231–239; doi:

data_4030243
_publ_section_title
;
 Synthesis and study on structure of tetramolybdenum (V) complex
 [Mo4(mu3-O)2O4Cl2(p-OCOC6H4CH3)6].2C6H5Cl
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              231
_journal_page_last               239
_journal_volume                  26
_journal_year                    1989
_chemical_formula_sum            'C60 H52 Cl4 Mo4 O18'
_chemical_formula_weight         1586.61
_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                78.72(3)
_cell_angle_beta                 74.21(2)
_cell_angle_gamma                83.90(3)
_cell_formula_units_Z            2
_cell_length_a                   11.869(3)
_cell_length_b                   16.896(7)
_cell_length_c                   17.586(5)
_cell_volume                     3322.8(19)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_refine_ls_number_reflns         8638
_refine_ls_R_factor_gt           0.0425
_refine_ls_wR_factor_gt          0.0474
_cod_data_source_file            EJSSIC-1989-26-231-239.cif
_cod_data_source_block           Mo-complex
_cod_database_code               4030243
The structures of lanthanum hydroxide nitrates investigated by the Rietveld profile refinement technique
Louer, M.; Louer, D.; Lopez Delgado, A.; Garcia Martinez, O.; European Journal of Solid State and Inorganic Chemistry 26 (1989) 241–253; doi:

data_4030244
_publ_section_title
;
 The structures of lanthanum hydroxide nitrates investigated by the
 Rietveld profile refinement technique
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              241
_journal_page_last               253
_journal_volume                  26
_journal_year                    1989
_chemical_formula_sum            'H2 La N O5'
_chemical_formula_weight         234.925
_space_group_IT_number           11
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 99.96(1)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.488(2)
_cell_length_b                   3.962(2)
_cell_length_c                   7.770(4)
_cell_volume                     196.72(15)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.5405981
_pd_proc_ls_prof_R_factor        0.054
_pd_proc_ls_prof_wR_expected     0.030
_pd_proc_ls_prof_wR_factor       0.073
_refine_ls_number_parameters     17
_refine_ls_number_reflns         181
_refine_ls_R_factor_gt           0.069
_refine_ls_R_I_factor            0.091
_cod_data_source_file            EJSSIC-1989-26-241-253-1.cif
_cod_data_source_block           La(OH)2NO3
_cod_original_sg_symbol_H-M      'P 21/m'
_cod_database_code               4030244
The structures of lanthanum hydroxide nitrates investigated by the Rietveld profile refinement technique
Louer, M.; Louer, D.; Lopez Delgado, A.; Garcia Martinez, O.; European Journal of Solid State and Inorganic Chemistry 26 (1989) 241–253; doi:

data_4030245
_publ_section_title
;
 The structures of lanthanum hydroxide nitrates investigated by the
 Rietveld profile refinement technique
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              241
_journal_page_last               253
_journal_volume                  26
_journal_year                    1989
_chemical_formula_sum            'H4 La N O6'
_chemical_formula_weight         252.94
_space_group_IT_number           12
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 114.15(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   21.192(2)
_cell_length_b                   3.9899(6)
_cell_length_c                   6.4048(8)
_cell_volume                     494.15(11)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.5405981
_pd_proc_ls_prof_R_factor        0.067
_pd_proc_ls_prof_wR_expected     0.063
_pd_proc_ls_prof_wR_factor       0.083
_refine_ls_number_parameters     30
_refine_ls_number_reflns         216
_refine_ls_R_factor_gt           0.068
_refine_ls_R_I_factor            0.088
_cod_data_source_file            EJSSIC-1989-26-241-253-2.cif
_cod_data_source_block           La(OH)2NO3-H2O
_cod_original_sg_symbol_H-M      'C 2/m'
_cod_database_code               4030245
A structural study of 12H-BaFe02.93
Parras, M.; Vallet-Regi, M.; Gonzalet-Calbet, J. M.; Grenier, J. C.; Hagenmullet, P.; Rodriguez-Carvajal, J.; European Journal of Solid State and Inorganic Chemistry 26 (1989) 299–312; doi:

data_4030246
_publ_section_title
;
 A structural study of 12H-BaFe02.93
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              299
_journal_page_last               312
_journal_volume                  26
_journal_year                    1989
_chemical_formula_sum            'Ba Fe O2.93'
_chemical_formula_weight         240.05
_space_group_IT_number           160
_symmetry_cell_setting           trigonal
_symmetry_Int_Tables_number      160
_symmetry_space_group_name_Hall  'R 3 -2"'
_symmetry_space_group_name_H-M   'R 3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120.
_cell_formula_units_Z            12
_cell_length_a                   5.6915(5)
_cell_length_b                   5.6915(5)
_cell_length_c                   27.981(1)
_cell_volume                     784.96(10)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.542
_exptl_crystal_density_diffrn    6.122
_pd_proc_ls_prof_wR_expected     0.0747
_pd_proc_ls_prof_wR_factor       0.1804
_refine_ls_R_I_factor            0.0747
_cod_data_source_file            EJSSIC-1989-26-299-312.cif
_cod_data_source_block           BaFeO2.93
_cod_original_cell_volume        20
_cod_original_sg_symbol_H-M      'R 3 m'
_cod_database_code               4030246
The crystal structure of CsBa2Cr2F11 : first evidence of vertex-sharing octahedral dimers in fluorides
Ferey, Gerard; Renaudin, Jean; de Kozak, Ariel; Mary, Yves; European Journal of Solid State and Inorganic Chemistry 26 (1989) 427–434; doi:

data_4030247
_publ_section_title
;
 The crystal structure of CsBa2Cr2F11 : first evidence of vertex-sharing
 octahedral dimers in fluorides
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              427
_journal_page_last               434
_journal_volume                  26
_journal_year                    1989
_chemical_formula_sum            'Ba2 Cr2 Cs F11'
_chemical_formula_weight         720.57
_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                   6.048(1)
_cell_length_b                   6.048(1)
_cell_length_c                   15.080(2)
_cell_volume                     551.60(15)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    12.330
_exptl_crystal_density_diffrn    4.338
_exptl_crystal_F_000             628
_refine_ls_number_parameters     20
_refine_ls_number_reflns         564
_refine_ls_R_factor_gt           0.027
_refine_ls_wR_factor_gt          0.030
_cod_data_source_file            EJSSIC-1989-26-427-434.cif
_cod_data_source_block           CsBa2Cr2F11
_cod_original_cell_volume        551.6(2)
_cod_database_code               4030247