LMucko/crystallography-open-database huggingface dataset:
Quaternary Selenidogermanates(IV) A3[AgGe4Se10].2H2O and A2[MnGe4Se10].3H2O (A = Rb, Cs) with Open Framework Structures
Loose, Anja; Sheldrick, William S.; Zeitschrift fur Naturforschung B 52 (1997) 687–602; doi:10.1515/znb-1997-0604

data_7228358
_publ_section_title
;
 Quaternary Selenidogermanates(IV) A3[AgGe4Se10].2H2O and
 A2[MnGe4Se10].3H2O (A = Rb, Cs) with Open Framework Structures
;
_journal_name_full               'Zeitschrift fur Naturforschung B'
_journal_page_first              687
_journal_page_last               602
_journal_paper_doi               10.1515/znb-1997-0604
_journal_volume                  52
_journal_year                    1997
_chemical_formula_sum            'Ag Ge4 H4 O2 Rb3 Se10'
_chemical_formula_weight         1480.46
_space_group_IT_number           82
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      82
_symmetry_space_group_name_Hall  'I -4'
_symmetry_space_group_name_H-M   'I -4'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   8.767(3)
_cell_length_b                   8.767(3)
_cell_length_c                   15.956(3)
_cell_volume                     1226.4(6)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    26.4
_exptl_crystal_density_diffrn    4.009
_exptl_crystal_F_000             1292
_refine_ls_goodness_of_fit_ref   0.841
_refine_ls_number_reflns         649
_refine_ls_R_factor_gt           0.036
_refine_ls_wR_factor_gt          0.079
_cod_data_source_file            Z-Naturforsch-1997-52b-687-692-1.cif
_cod_data_source_block           Rb3
_cod_original_cell_volume        1226.4(8)
_cod_original_formula_sum        'H4 Ag Ge4 O2 Rb3 Se10'
_cod_database_code               7228358
Quaternary Selenidogermanates(IV) A3[AgGe4Se10].2H2O and A2[MnGe4Se10].3H2O (A = Rb, Cs) with Open Framework Structures
Loose, Anja; Sheldrick, William S.; Zeitschrift fur Naturforschung B 52 (1997) 687–602; doi:10.1515/znb-1997-0604

data_7228359
_publ_section_title
;
 Quaternary Selenidogermanates(IV) A3[AgGe4Se10].2H2O and
 A2[MnGe4Se10].3H2O (A = Rb, Cs) with Open Framework Structures
;
_journal_name_full               'Zeitschrift fur Naturforschung B'
_journal_page_first              687
_journal_page_last               602
_journal_paper_doi               10.1515/znb-1997-0604
_journal_volume                  52
_journal_year                    1997
_chemical_formula_sum            'Ag Cs3 Ge4 H4 O2 Se10'
_chemical_formula_weight         1622.77
_space_group_IT_number           82
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      82
_symmetry_space_group_name_Hall  'I -4'
_symmetry_space_group_name_H-M   'I -4'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   8.956(1)
_cell_length_b                   8.956(1)
_cell_length_c                   16.036(3)
_cell_volume                     1286.2(3)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    23.7
_exptl_crystal_density_diffrn    4.190
_exptl_crystal_F_000             1400
_refine_ls_goodness_of_fit_ref   0.996
_refine_ls_number_reflns         856
_refine_ls_R_factor_gt           0.057
_refine_ls_wR_factor_gt          0.139
_cod_data_source_file            Z-Naturforsch-1997-52b-687-692-2.cif
_cod_data_source_block           Cs3
_cod_original_formula_sum        'H4 Ag Cs3 Ge4 O2 Se10'
_cod_database_code               7228359
Quaternary Selenidogermanates(IV) A3[AgGe4Se10].2H2O and A2[MnGe4Se10].3H2O (A = Rb, Cs) with Open Framework Structures
Loose, Anja; Sheldrick, William S.; Zeitschrift fur Naturforschung B 52 (1997) 687–602; doi:10.1515/znb-1997-0604

data_7228360
_publ_section_title
;
 Quaternary Selenidogermanates(IV) A3[AgGe4Se10].2H2O and
 A2[MnGe4Se10].3H2O (A = Rb, Cs) with Open Framework Structures
;
_journal_name_full               'Zeitschrift fur Naturforschung B'
_journal_page_first              687
_journal_page_last               602
_journal_paper_doi               10.1515/znb-1997-0604
_journal_volume                  52
_journal_year                    1997
_chemical_formula_sum            'Ge4 H6 Mn O3 Rb2 Se10'
_chemical_formula_weight         1359.9
_space_group_IT_number           82
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      82
_symmetry_space_group_name_Hall  'I -4'
_symmetry_space_group_name_H-M   'I -4'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   8.886(3)
_cell_length_b                   8.886(3)
_cell_length_c                   15.433(8)
_cell_volume                     1218.6(9)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    24.3
_exptl_crystal_density_diffrn    3.706
_exptl_crystal_F_000             1194
_refine_ls_goodness_of_fit_ref   0.963
_refine_ls_number_reflns         1224
_refine_ls_R_factor_gt           0.071
_refine_ls_wR_factor_gt          0.169
_cod_data_source_file            Z-Naturforsch-1997-52b-687-692-3.cif
_cod_data_source_block           Rb2
_cod_original_formula_sum        'H6 Ge4 Mn O3 Rb2 Se10'
_cod_database_code               7228360
Quaternary Selenidogermanates(IV) A3[AgGe4Se10].2H2O and A2[MnGe4Se10].3H2O (A = Rb, Cs) with Open Framework Structures
Loose, Anja; Sheldrick, William S.; Zeitschrift fur Naturforschung B 52 (1997) 687–602; doi:10.1515/znb-1997-0604

data_7228361
_publ_section_title
;
 Quaternary Selenidogermanates(IV) A3[AgGe4Se10].2H2O and
 A2[MnGe4Se10].3H2O (A = Rb, Cs) with Open Framework Structures
;
_journal_name_full               'Zeitschrift fur Naturforschung B'
_journal_page_first              687
_journal_page_last               602
_journal_paper_doi               10.1515/znb-1997-0604
_journal_volume                  52
_journal_year                    1997
_chemical_formula_sum            'Cs2 Ge4 H6 Mn O3 Se10'
_chemical_formula_weight         1454.8
_space_group_IT_number           82
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      82
_symmetry_space_group_name_Hall  'I -4'
_symmetry_space_group_name_H-M   'I -4'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   8.859(1)
_cell_length_b                   8.859(1)
_cell_length_c                   15.448(3)
_cell_volume                     1212.4(3)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    23.4
_exptl_crystal_density_diffrn    3.985
_exptl_crystal_F_000             1266
_refine_ls_goodness_of_fit_ref   1.010
_refine_ls_number_reflns         679
_refine_ls_R_factor_gt           0.045
_refine_ls_wR_factor_gt          0.113
_cod_data_source_file            Z-Naturforsch-1997-52b-687-692-4.cif
_cod_data_source_block           Cs2
_cod_original_formula_sum        'H6 Cs2 Ge4 Mn O3 Se10'
_cod_database_code               7228361
Redetermination by neutron diffraction of the structure of manganese acetate tetrahydrate (MAT)
Tranqui, D.; Burlet, P.; Filhol, A.; Thomas, M.; Acta Crystallographica, Section B 33 (1977) 1357–1361; doi:10.1107/S0567740877006086

data_2108046
_publ_section_title
;
 Redetermination by neutron diffraction of the structure of manganese
 acetate tetrahydrate (MAT)
;
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              1357
_journal_page_last               1361
_journal_paper_doi               10.1107/S0567740877006086
_journal_volume                  33
_journal_year                    1977
_chemical_formula_sum            'C4 H14 Mn O8'
_chemical_formula_weight         245.087
_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                 118.62(5)
_cell_angle_gamma                90.
_cell_formula_units_Z            6
_cell_length_a                   11.10(1)
_cell_length_b                   17.51(2)
_cell_length_c                   9.09(1)
_cell_volume                     1551(3)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          neutron
_diffrn_radiation_wavelength     1.217
_exptl_absorpt_coefficient_mu    0.243
_exptl_crystal_density_diffrn    1.574
_refine_ls_number_reflns         1401
_refine_ls_R_factor_gt           0.05
_cod_data_source_file            Acta-Cryst-1977-B33-1357-1361.cif
_cod_data_source_block           MAT-neutron
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'H14 C4 Mn O8'
_cod_database_code               2108046
The structure of Na6Zn3(AsO4)4.3H2O and its relationship to the garnet and other Ia3d-derived structures
Grey, Ian E.; Madsen, Ian C.; Jones, David J.; Smith, Peter W.; Journal of Solid State Chemistry 82 (1989) 52–59; doi:10.1016/0022-4596(89)90221-1

data_1546271
_publ_section_title
;
 The structure of Na6Zn3(AsO4)4.3H2O and its relationship to the garnet
 and other Ia3d-derived structures
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              52
_journal_page_last               59
_journal_paper_doi               10.1016/0022-4596(89)90221-1
_journal_volume                  82
_journal_year                    1989
_chemical_formula_sum            'As4 H6 Na6 O19 Zn3'
_chemical_formula_weight         943.888
_space_group_IT_number           198
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      198
_symmetry_space_group_name_Hall  'P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P 21 3'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   12.243(3)
_cell_length_b                   12.243(3)
_cell_length_c                   12.243(3)
_cell_volume                     1835.1(8)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    11.285
_exptl_crystal_density_diffrn    3.394
_exptl_crystal_F_000             880
_refine_ls_number_parameters     39
_refine_ls_number_reflns         548
_refine_ls_wR_factor_gt          0.028
_cod_data_source_file            JSSC-1989-82-52-59.cif
_cod_data_source_block           Na6Zn3
_cod_original_cell_volume        1835.1(13)
_cod_original_formula_sum        'H6 As4 Na6 O19 Zn3'
_cod_database_code               1546271
Evolutionary programming techniques for predicting inorganic crystal structures
Bush, T. S.; Catlow, C. R. A.; Battle, P. D.; Journal of Materials Chemistry 5 (1995) 1269–1272; doi:

data_7228418
_publ_section_title
;
 Evolutionary programming techniques for predicting inorganic crystal
 structures
;
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              1269
_journal_page_last               1272
_journal_volume                  5
_journal_year                    1995
_chemical_formula_moiety         'O4 Ru, 3(Li)'
_chemical_formula_sum            'Li3 O4 Ru'
_chemical_formula_weight         185.89
_space_group_IT_number           13
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      13
_symmetry_space_group_name_Hall  '-P 2ya'
_symmetry_space_group_name_H-M   'P 1 2/a 1'
_cell_angle_alpha                90.
_cell_angle_beta                 110.039(1)
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   5.10555(8)
_cell_length_b                   5.85403(7)
_cell_length_c                   5.10587(6)
_cell_volume                     143.366(3)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.5418
_exptl_absorpt_coefficient_mu    42.874
_exptl_crystal_density_diffrn    4.306
_exptl_crystal_F_000             170
_pd_proc_ls_prof_R_factor        0.13
_pd_proc_ls_prof_wR_factor       0.182
_refine_ls_R_I_factor            0.084
_cod_data_source_file            J-Mater-Chem-1995-5-1269-1272.cif
_cod_data_source_block           Li3RuO4
_cod_depositor_comments
;
No thermal parameters provided, U = 0.01 fixed 

 Error in the title corrected
;
_cod_original_sg_symbol_H-M      'P 2/a'
_cod_database_code               7228418
Crystal structure and hydrogen bonding in Li/H-exchanged petalite, HAlSi4O10
Effenberger, H.; Fuess, H.; Muller, G.; Vogt, T.; Zeitschrift fur Kristallographie 197 (1991) 27–40; doi:10.1524/zkri.1991.197.14.27

data_8104527
_publ_section_title
;
 Crystal structure and hydrogen bonding in Li/H-exchanged petalite,
 HAlSi4O10
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              27
_journal_page_last               40
_journal_paper_doi               10.1524/zkri.1991.197.14.27
_journal_volume                  197
_journal_year                    1991
_chemical_formula_sum            'Al H O10 Si4'
_chemical_formula_weight         300.325
_space_group_IT_number           1
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      1
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                93.0(1)
_cell_angle_beta                 113.1(1)
_cell_angle_gamma                90.1(1)
_cell_formula_units_Z            1
_cell_length_a                   5.867(3)
_cell_length_b                   4.927(3)
_cell_length_c                   7.524(4)
_cell_volume                     199.7(2)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    0.79
_exptl_crystal_density_diffrn    2.49
_exptl_crystal_F_000             150
_refine_ls_number_parameters     133
_refine_ls_number_reflns         1011
_refine_ls_R_factor_gt           0.053
_refine_ls_wR_factor_gt          0.045
_cod_data_source_file            Z-Krist-1991-197-27-40.cif
_cod_data_source_block           HAlSi4O18
_cod_depositor_comments
;
Hydrogen aton located in the short O...O contact
O4A-O6B from Rietveld refinement of neutron powder data.
Origin fixed by the Si1a coordinates
;
_cod_original_formula_sum        'H Al O10 Si4'
_cod_database_code               8104527
Elucidation of the Elusive Structure and Formula of the Active Pharmaceutical Ingredient Bismuth Subgallate by Continuous Rotation Electron Diffraction
Wang, Yunchen; Takki, Sofia; Cheung, Ocean; Xu, Hong-Yi; Wan, Wei; Öhrström, Lars R.; Inge, Andrew Ken; Chem. Commun.  (2017) –; doi:10.1039/C7CC03180G

data_7120238
_publ_section_title
;
 Elucidation of the Elusive Structure and Formula of the Active
 Pharmaceutical Ingredient Bismuth Subgallate by Continuous Rotation
 Electron Diffraction
;
_journal_name_full               'Chem. Commun.'
_journal_paper_doi               10.1039/C7CC03180G
_journal_year                    2017
_chemical_formula_sum            'C7 Bi O8'
_chemical_formula_weight         423.07
_chemical_name_common            'bismuth gallate'
_chemical_name_mineral           'bismuth subgallate'
_chemical_name_systematic        'bismuth subgallate'
_space_group_crystal_system      orthorhombic
_space_group_IT_number           53
_space_group_name_Hall           '-P 2ac 2'
_space_group_name_H-M_alt        'P m n a'
_symmetry_space_group_name_Hall  '-P 2ac 2'
_symmetry_space_group_name_H-M   'P m n a'
_audit_update_record
;
2017-03-17 deposited with the CCDC.
2017-06-07 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.54221(16)
_cell_length_b                   4.66794(9)
_cell_length_c                   23.7131(4)
_cell_measurement_reflns_used    648
_cell_measurement_temperature    293
_cell_measurement_theta_max      109.98356514
_cell_measurement_theta_min      3.00656514
_cell_volume                     945.55(3)
_computing_publication_material  'PLATON (Spek, 2003)'
_diffrn_ambient_temperature      293
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measurement_device_type  'PANalytical X'Per PRO MPD'
_diffrn_radiation_type           'Cu K\a1'
_diffrn_radiation_wavelength     1.5406
_diffrn_reflns_number            648
_exptl_crystal_colour            colorless
_exptl_crystal_description       plate
_pd_meas_2theta_range_inc        0.013
_pd_meas_2theta_range_max        109.98356514
_pd_meas_2theta_range_min        3.00656514
_pd_meas_number_of_points        8234
_pd_proc_ls_background_function  'square polynomial for each range'
_pd_proc_ls_prof_R_factor        0.117953908
_pd_proc_ls_prof_wR_expected     0.09405
_pd_proc_ls_prof_wR_factor       0.16436
_refine_ls_goodness_of_fit_all   1.748
_refine_ls_R_I_factor            0.06256
_cod_data_source_file            c7cc03180g2.cif
_cod_data_source_block           bsg
_cod_original_sg_symbol_H-M      Pmna
_cod_database_code               7120238
The dehydration and rehydration processes in the natural zeolite mesolite studied by conventional and synchrotron X-ray powder diffraction
Stahl, Kenny; Thomasson, Ronnie; Zeolites 14 (1994) 12–17; doi:10.1016/0144-2449(94)90048-5

data_1546276
_publ_section_title
;
 The dehydration and rehydration processes in the natural zeolite mesolite
 studied by conventional and synchrotron X-ray powder diffraction
;
_journal_name_full               Zeolites
_journal_page_first              12
_journal_page_last               17
_journal_paper_doi               10.1016/0144-2449(94)90048-5
_journal_volume                  14
_journal_year                    1994
_chemical_formula_sum            'Al16 Ca5.33 H22.6 Na5.33 O91.3 Si24'
_chemical_formula_weight         2925.43
_space_group_IT_number           43
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      43
_symmetry_space_group_name_Hall  'F 2 -2d'
_symmetry_space_group_name_H-M   'F d d 2'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            1
_cell_length_a                   18.11287(8)
_cell_length_b                   18.63331(8)
_cell_length_c                   6.56618(3)
_cell_volume                     2216.104(17)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_source         synchrotron
_diffrn_radiation_wavelength     1.1999
_exptl_crystal_density_diffrn    2.064
_pd_proc_ls_prof_R_factor        0.0570
_pd_proc_ls_prof_wR_factor       0.0739
_refine_ls_goodness_of_fit_ref   2.82
_refine_ls_number_parameters     58
_refine_ls_number_reflns         727
_refine_ls_R_I_factor            0.0208
_cod_data_source_file            Zeolites-1994-14-12-17-1.cif
_cod_data_source_block           M523
_cod_original_formula_sum        'H22.6 Al16 Ca5.33 Na5.33 O91.3 Si24'
_cod_database_code               1546276
The dehydration and rehydration processes in the natural zeolite mesolite studied by conventional and synchrotron X-ray powder diffraction
Stahl, Kenny; Thomasson, Ronnie; Zeolites 14 (1994) 12–17; doi:10.1016/0144-2449(94)90048-5

data_1546277
_publ_section_title
;
 The dehydration and rehydration processes in the natural zeolite mesolite
 studied by conventional and synchrotron X-ray powder diffraction
;
_journal_name_full               Zeolites
_journal_page_first              12
_journal_page_last               17
_journal_paper_doi               10.1016/0144-2449(94)90048-5
_journal_volume                  14
_journal_year                    1994
_chemical_formula_sum            'Al16 Ca5.33 H46.4 Na5.33 O103.2 Si24'
_chemical_formula_weight         3139.81
_space_group_IT_number           43
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      43
_symmetry_space_group_name_Hall  'F 2 -2d'
_symmetry_space_group_name_H-M   'F d d 2'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            1
_cell_length_a                   18.6180(9)
_cell_length_b                   19.0312(9)
_cell_length_c                   6.5421(3)
_cell_volume                     2318.02(19)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54056
_exptl_crystal_density_diffrn    2.123
_pd_proc_ls_prof_R_factor        0.0803
_pd_proc_ls_prof_wR_factor       0.1007
_refine_ls_goodness_of_fit_ref   5.00
_refine_ls_number_parameters     59
_refine_ls_number_reflns         449
_refine_ls_R_I_factor            0.0178
_cod_data_source_file            Zeolites-1994-14-12-17-2.cif
_cod_data_source_block           R523
_cod_original_formula_sum        'H46.4 Al16 Ca5.33 Na5.33 O103.2 Si24'
_cod_database_code               1546277
Crystal structure of a K-rich natural gmelinite and comparison with the other refined gmelinite samples
Vezzalini, Giovanna; Quartieri, Simona; Passaglia, Elio; Neues Jahrbuch fur Mineralogie-Monatshefte 11 (1990) 504–516; doi:

data_1546283
_publ_section_title
;
 Crystal structure of a K-rich natural gmelinite and comparison with the
 other refined gmelinite samples
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie-Monatshefte'
_journal_page_first              504
_journal_page_last               516
_journal_volume                  11
_journal_year                    1990
_chemical_formula_sum
'Al7.79 Ca1.67 H47 K2.72 Mg0.13 Na0.22 O71.5 Si16.32 Sr0.39'
_chemical_formula_weight         2075.64
_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            1
_cell_length_a                   13.621(3)
_cell_length_b                   13.621(3)
_cell_length_c                   10.254(1)
_cell_volume                     1647.6(5)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_refine_ls_number_reflns         734
_refine_ls_R_factor_gt           0.0677
_refine_ls_wR_factor_gt          0.0592
_cod_data_source_file            N-Jb-Miner-Mh-1990-11-504-516.cif
_cod_data_source_block           Gmelinite
_cod_original_cell_volume        1647.6(9)
_cod_original_formula_sum
'H47 Al7.79 Ca1.67 K2.72 Mg0.13 Na0.22 O71.5 Si16.32 Sr0.39'
_cod_database_code               1546283