LMucko/crystallography-open-database huggingface dataset:
Crystal structure of ammine silver(I) p-nitrobenzoate
Jaber, F.; Charbonnier, F.; Faure, R.; European Journal of Solid State and Inorganic Chemistry 32 (1995) 25–33; doi:

data_4030717
_publ_section_title
;
 Crystal structure of ammine silver(I) p-nitrobenzoate
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              25
_journal_page_last               33
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'C14 H11 Ag2 N3 O8'
_chemical_formula_weight         564.9
_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                 104.64(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   21.141(3)
_cell_length_b                   6.459(1)
_cell_length_c                   12.219(1)
_cell_volume                     1614.3(4)
_diffrn_ambient_temperature      290
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    2.11
_exptl_crystal_density_diffrn    2.32
_refine_ls_number_parameters     126
_refine_ls_number_reflns         2340
_refine_ls_R_factor_gt           0.039
_refine_ls_wR_factor_gt          0.039
_cod_data_source_file            EJSSIC-1995-32-25-33.cif
_cod_data_source_block           C14H11N3O8Ag2
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4030717
Synthesis and crystal structure of a calcium nitride deuteride Ca2ND
Sichla, T.; Jacobs, H.; European Journal of Solid State and Inorganic Chemistry 32 (1995) 49–56; doi:

data_4030718
_publ_section_title
;
 Synthesis and crystal structure of a calcium nitride deuteride Ca2ND
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              49
_journal_page_last               56
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'Ca2 D N'
_chemical_formula_weight         96.18
_space_group_IT_number           227
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   10.138(1)
_cell_length_b                   10.138(1)
_cell_length_c                   10.138(1)
_cell_volume                     1041.97(18)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           AgK\a
_diffrn_radiation_wavelength     0.56087
_exptl_absorpt_coefficient_mu    2.021
_exptl_crystal_density_diffrn    2.452
_exptl_crystal_F_000             768
_refine_ls_number_parameters     8
_refine_ls_number_reflns         158
_refine_ls_R_factor_gt           0.024
_refine_ls_wR_factor_gt          0.023
_cod_data_source_file            EJSSIC-1995-32-49-56.cif
_cod_data_source_block           Ca2ND
_cod_original_cell_volume        1042.0(3)
_cod_original_sg_symbol_H-M      'F d -3 m'
_cod_database_code               4030718
Structure of an hydrated tetrapropylammonium polytungstate H3W12O40[N(C3H7)4]5.2H2O
Seguin, L.; Gerand, B.; Nowogrocki, G.; European Journal of Solid State and Inorganic Chemistry 32 (1995) 181–194; doi:

data_4030719
_publ_section_title
;
 Structure of an hydrated tetrapropylammonium polytungstate
 H3W12O40[N(C3H7)4]5.2H2O
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              181
_journal_page_last               194
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'C60 H147 N5 O42 W12'
_chemical_formula_weight         3816.89
_space_group_IT_number           88
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      88
_symmetry_space_group_name_Hall  '-I 4ad'
_symmetry_space_group_name_H-M   'I 41/a :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   20.24(1)
_cell_length_b                   20.24(1)
_cell_length_c                   46.88(3)
_cell_volume                     19205(18)
_diffrn_ambient_temperature      298
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    15.5
_exptl_crystal_density_diffrn    2.75
_refine_ls_number_parameters     369
_refine_ls_number_reflns         2907
_refine_ls_R_factor_gt           0.039
_refine_ls_wR_factor_gt          0.039
_cod_data_source_file            EJSSIC-1995-32-181-194.cif
_cod_data_source_block           H3W12O40
_cod_depositor_comments
;
x atomic coordinate of C10 changed from 0.341 to 0.241
(guessed...)
;
_cod_original_cell_volume        19205(23)
_cod_original_sg_symbol_H-M      'I 41/a'
_cod_database_code               4030719
CaFe3(PO4)3(H2O): A mixed-valence iron phosphate containing zigzag chains of FeO6 octahedra
Kwang-Hwa Lii; Chih-Yuan Huang; European Journal of Solid State and Inorganic Chemistry 32 (1995) 225–235; doi:

data_4030720
_publ_section_title
;
 CaFe3(PO4)3(H2O): A mixed-valence iron phosphate containing zigzag chains
 of FeO6 octahedra
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              225
_journal_page_last               235
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'Ca Fe3 H2 O13 P3'
_chemical_formula_weight         510.56
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.538(2)
_cell_length_b                   11.670(2)
_cell_length_c                   12.699(1)
_cell_volume                     1858.1(5)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.70930
_exptl_absorpt_coefficient_mu    5.775
_exptl_crystal_density_diffrn    3.650
_exptl_crystal_F_000             1992
_refine_ls_number_parameters     188
_refine_ls_number_reflns         1338
_refine_ls_R_factor_gt           0.0287
_refine_ls_wR_factor_gt          0.0292
_cod_data_source_file            EJSSIC-1995-32-225-235.cif
_cod_data_source_block           CaFe3
_cod_original_formula_sum        'H2 Ca Fe3 O13 P3'
_cod_database_code               4030720
Catalytic asymmetric dearomatizing redox cross coupling of ketones with aryl hydrazines giving 1,4-diketones.
Huang, Shenlin; Kötzner, Lisa; De, Chandra Kanta; List, Benjamin; Journal of the American Chemical Society 137 (2015) 3446–3449; doi:10.1021/ja511200j

data_4123471
_publ_section_title
;
 Catalytic asymmetric dearomatizing redox cross coupling of ketones with
 aryl hydrazines giving 1,4-diketones.
;
_journal_issue                   10
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              3446
_journal_page_last               3449
_journal_paper_doi               10.1021/ja511200j
_journal_volume                  137
_journal_year                    2015
_chemical_absolute_configuration rmad
_chemical_compound_source        'see paper'
_chemical_formula_moiety         'C16 H16 O3'
_chemical_formula_sum            'C16 H16 O3'
_chemical_formula_weight         256.29
_space_group_crystal_system      monoclinic
_space_group_IT_number           4
_space_group_name_Hall           'P 2yb'
_space_group_name_H-M_alt        'P 1 21 1'
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_audit_block_code                HGS-HB-224-12
_audit_creation_date             2014-05-28
_audit_creation_method
;
Olex2 1.2
(compiled 2014.03.20 svn.r2914 for OlexSys, GUI svn.r4816)
;
_cell_angle_alpha                90
_cell_angle_beta                 105.9253(11)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.7791(2)
_cell_length_b                   10.1381(4)
_cell_length_c                   9.7026(3)
_cell_measurement_reflns_used    9857
_cell_volume                     641.24(4)
_refine_ls_R_factor_all          0.0315
_refine_ls_R_factor_gt           0.0311
_refine_ls_wR_factor_gt          0.0793
_refine_ls_wR_factor_ref         0.0797
_cod_data_source_file            ja511200j_si_001.cif
_cod_data_source_block           8791sadabs
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'MONOCLINIC' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 

 Adding full bibliography for 4123471--4123472.cif.
;
_cod_original_sg_symbol_Hall     'p 2yb'
_cod_original_sg_symbol_H-M      P21
_cod_database_code               4123471
_shelxl_version_number           2014-3
Catalytic asymmetric dearomatizing redox cross coupling of ketones with aryl hydrazines giving 1,4-diketones.
Huang, Shenlin; Kötzner, Lisa; De, Chandra Kanta; List, Benjamin; Journal of the American Chemical Society 137 (2015) 3446–3449; doi:10.1021/ja511200j

data_4123472
_publ_section_title
;
 Catalytic asymmetric dearomatizing redox cross coupling of ketones with
 aryl hydrazines giving 1,4-diketones.
;
_journal_issue                   10
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              3446
_journal_page_last               3449
_journal_paper_doi               10.1021/ja511200j
_journal_volume                  137
_journal_year                    2015
_chemical_compound_source        chloroforme
_chemical_formula_moiety         'C23 H23 N O4 S'
_chemical_formula_sum            'C23 H23 N O4 S'
_chemical_formula_weight         409.48
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_audit_block_code                8992
_audit_creation_date             2014-09-18
_audit_creation_method
;
Olex2 1.2
(compiled 2014.08.28 svn.r2986 for OlexSys, GUI svn.r4874)
;
_cell_angle_alpha                69.4491(13)
_cell_angle_beta                 84.6054(14)
_cell_angle_gamma                80.4413(15)
_cell_formula_units_Z            2
_cell_length_a                   9.1382(3)
_cell_length_b                   9.9898(3)
_cell_length_c                   11.5919(4)
_cell_measurement_reflns_used    9142
_cell_volume                     976.38(6)
_refine_ls_R_factor_all          0.0436
_refine_ls_R_factor_gt           0.0393
_refine_ls_wR_factor_gt          0.0945
_refine_ls_wR_factor_ref         0.0974
_cod_data_source_file            ja511200j_si_002.cif
_cod_data_source_block           8992sadabs
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'TRICLINIC' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 

 Adding full bibliography for 4123471--4123472.cif.
;
_cod_original_sg_symbol_Hall     '-p 1'
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               4123472
Oxyfluorinated compounds with open structures. XII. Synthesis and crystal structure of ULM-11 or [FeF(HPO4), en]; structural relations with ULM-10 and mineral curetonite
Cavellec, M.; Riou, D.; Ferey, G.; European Journal of Solid State and Inorganic Chemistry 32 (1995) 271–281; doi:

data_4030721
_publ_section_title
;
 Oxyfluorinated compounds with open structures. XII. Synthesis and crystal
 structure of ULM-11 or [FeF(HPO4), en]; structural relations with ULM-10
 and mineral curetonite
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              271
_journal_page_last               281
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'C2 H9 F Fe N2 O4 P'
_chemical_formula_weight         230.93
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 101.19(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.215(2)
_cell_length_b                   7.427(2)
_cell_length_c                   9.881(3)
_cell_volume                     663.4(3)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    2.564
_exptl_crystal_density_diffrn    2.312
_exptl_crystal_F_000             468
_refine_ls_number_parameters     111
_refine_ls_number_reflns         2339
_refine_ls_R_factor_gt           0.039
_refine_ls_wR_factor_gt          0.100
_cod_data_source_file            EJSSIC-1995-32-271-281.cif
_cod_data_source_block           ULM-11
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4030721
Synthesis and crystal structure of a new microporous thioantimonate(III) [H3N(CH2)3NH3]Sb10S16
Xiqu Wang; European Journal of Solid State and Inorganic Chemistry 32 (1995) 303–312; doi:

data_4030722
_publ_section_title
;
 Synthesis and crystal structure of a new microporous thioantimonate(III)
 [H3N(CH2)3NH3]Sb10S16
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              303
_journal_page_last               312
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'C3 H12 N2 S16 Sb10'
_chemical_formula_weight         1806.78
_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                 111.44(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   18.359(4)
_cell_length_b                   10.927(2)
_cell_length_c                   17.389(3)
_cell_volume                     3247.0(12)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    9.213
_exptl_crystal_density_diffrn    3.696
_refine_ls_number_parameters     256
_refine_ls_number_reflns         3210
_refine_ls_R_factor_gt           0.071
_refine_ls_wR_factor_gt          0.162
_cod_data_source_file            EJSSIC-1995-32-303-312.cif
_cod_data_source_block           Sb10S16
_cod_original_cell_volume        3247(1)
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4030722
Structure of Na3.12Fe2.44(P2O7)2
Angenault, J.; Couturier, J.-C.; Quarton, M.; Robert, F.; European Journal of Solid State and Inorganic Chemistry 32 (1995) 335–343; doi:

data_4030723
_publ_section_title
;
 Structure of Na3.12Fe2.44(P2O7)2
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              335
_journal_page_last               343
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'Fe2.44 Na3.12 O14 P4'
_chemical_formula_weight         555.877
_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                64.77(1)
_cell_angle_beta                 86.21(2)
_cell_angle_gamma                73.13(2)
_cell_formula_units_Z            2
_cell_length_a                   6.424(2)
_cell_length_b                   9.440(1)
_cell_length_c                   10.981(2)
_cell_volume                     575.2(2)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    3.302
_exptl_crystal_density_diffrn    3.21
_refine_ls_number_parameters     221
_refine_ls_number_reflns         1556
_refine_ls_R_factor_gt           0.035
_refine_ls_wR_factor_gt          0.039
_cod_data_source_file            EJSSIC-1995-32-335-343.cif
_cod_data_source_block           NaFePO
_cod_database_code               4030723
Preparation and characterization of a trioxofluorochromate(VI) and a trichromate(VI) of 2-methylquinolinium
Lorenzio Luis, P. A.; Martin-Zarza, P.; Gili, P.; Arrieta, J. M.; Germain, G.; Dupont, L.; European Journal of Solid State and Inorganic Chemistry 32 (1995) 353–360; doi:

data_4030724
_publ_section_title
;
 Preparation and characterization of a trioxofluorochromate(VI) and a
 trichromate(VI) of 2-methylquinolinium
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              353
_journal_page_last               360
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'C20 H20 Cr3 N2 O10'
_chemical_formula_weight         604.38
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 98.00(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.9391(7)
_cell_length_b                   17.139(3)
_cell_length_c                   8.858(2)
_cell_volume                     1193.6(4)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    1.399
_exptl_crystal_density_diffrn    1.682
_exptl_crystal_F_000             612
_refine_ls_number_parameters     319
_refine_ls_number_reflns         2435
_refine_ls_R_factor_gt           0.0358
_refine_ls_wR_factor_gt          0.1062
_cod_data_source_file            EJSSIC-1995-32-353-360.cif
_cod_data_source_block           C20H20N2Cr3O10
_cod_depositor_comments
;
systematic errors in the coordiantes where all values
like 0.1109 or 0.1016 (etc) were in fact 1.109 or 1.016 (etc)
;
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               4030724
Hydrothermal synthesis and structures of Cu2Mn(PO4)2(H2O) and CuMn2(PO4)2(H2O)
Liao, J.-H.; Leroux, F.; Guyomard, D.; Piffard, Y.; Tournoux, M.; European Journal of Solid State and Inorganic Chemistry 32 (1995) 403–414; doi:

data_4030728
_publ_section_title
;
 Hydrothermal synthesis and structures of Cu2Mn(PO4)2(H2O) and
 CuMn2(PO4)2(H2O)
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              403
_journal_page_last               414
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'Cu2 H2 Mn O9 P2'
_chemical_formula_weight         390.0
_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                 96.08(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.381(2)
_cell_length_b                   6.181(2)
_cell_length_c                   20.314(4)
_cell_volume                     671.8(4)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    8.629
_exptl_crystal_density_diffrn    3.885
_refine_ls_number_parameters     73
_refine_ls_number_reflns         1368
_refine_ls_R_factor_gt           0.060
_refine_ls_wR_factor_gt          0.068
_cod_data_source_file            EJSSIC-1995-32-403-414-1.cif
_cod_data_source_block           Cu2Mn
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_original_formula_sum        'H2 Cu2 Mn O9 P2'
_cod_database_code               4030728
Hydrothermal synthesis and structures of Cu2Mn(PO4)2(H2O) and CuMn2(PO4)2(H2O)
Liao, J.-H.; Leroux, F.; Guyomard, D.; Piffard, Y.; Tournoux, M.; European Journal of Solid State and Inorganic Chemistry 32 (1995) 403–414; doi:

data_4030729
_publ_section_title
;
 Hydrothermal synthesis and structures of Cu2Mn(PO4)2(H2O) and
 CuMn2(PO4)2(H2O)
;
_journal_name_full
'European Journal of Solid State and Inorganic Chemistry'
_journal_page_first              403
_journal_page_last               414
_journal_volume                  32
_journal_year                    1995
_chemical_formula_sum            'Cu H2 Mn2 O9 P2'
_chemical_formula_weight         381.4
_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                 115.11(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.332(1)
_cell_length_b                   10.094(2)
_cell_length_c                   9.092(1)
_cell_volume                     692.40(19)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    7.133
_exptl_crystal_density_diffrn    3.663
_refine_ls_number_parameters     72
_refine_ls_number_reflns         1448
_refine_ls_R_factor_gt           0.078
_refine_ls_wR_factor_gt          0.083
_cod_data_source_file            EJSSIC-1995-32-403-414-2.cif
_cod_data_source_block           CuMn2
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_original_formula_sum        'H2 Cu Mn2 O9 P2'
_cod_database_code               4030729