LMucko/crystallography-open-database huggingface dataset:
Theoretical structure determination of gamma-(Al2 O3)
Gutierrez, G.; Taga, A.; Johansson, B.; Physical Review, Serie 3. B - Condensed Matter (18,1978-) 65 (2002) 012101/1–012101/4; doi:

data_1531489
_publ_section_title
;
 Theoretical structure determination of gamma-(Al2 O3)
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              012101/1
_journal_page_last               012101/4
_journal_volume                  65
_journal_year                    2002
_chemical_formula_sum            'Al2.666 O3.999'
_chemical_name_systematic        '(Al2 O3)1.333'
_space_group_IT_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            8
_cell_length_a                   7.887
_cell_length_b                   7.887
_cell_length_c                   7.887
_cell_volume                     490.609
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Gutierrez_PRBMDO_2002_639.cif
_cod_data_source_block           Al2.666O3.999
_cod_database_code               1531489
Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ti und A = Rb, Cs
Hofmann, B.; Hoppe, R.; Zeitschrift fuer Anorganische und Allgemeine Chemie 458 (1979) 151–162; doi:

data_1531490
_publ_section_title
;
 Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ti und A = Rb, Cs
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              151
_journal_page_last               162
_journal_volume                  458
_journal_year                    1979
_chemical_formula_sum            'Cs3 F7 Si'
_chemical_name_systematic        'Cs3 (Si F6) F'
_space_group_IT_number           127
_symmetry_space_group_name_Hall  '-P 4 2ab'
_symmetry_space_group_name_H-M   'P 4/m b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.306
_cell_length_b                   8.306
_cell_length_c                   6.17
_cell_volume                     425.666
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hofmann_ZAACAB_1979_1066.cif
_cod_data_source_block           Cs3F7Si1
_cod_original_formula_sum        'Cs3 F7 Si1'
_cod_database_code               1531490
Crystal structure determination of systematically intergrown compounds: Li5 (O H)2 Br3 and Li2 (O H) Br
Friese, K.; Hoennerscheid, A.; Jansen, M.; Zeitschrift fuer Kristallographie (149,1979-) 218 (2003) 536–541; doi:

data_8103749
_publ_section_title
;
 Crystal structure determination of systematically intergrown compounds:
 Li5 (O H)2 Br3 and Li2 (O H) Br
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              536
_journal_page_last               541
_journal_volume                  218
_journal_year                    2003
_chemical_formula_sum            'Br3 H2 Li5 O2'
_chemical_name_systematic        'Li5 (O H)2 Br3'
_space_group_IT_number           119
_symmetry_space_group_name_Hall  'I -4 -2'
_symmetry_space_group_name_H-M   'I -4 m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.02335
_cell_length_b                   4.02335
_cell_length_c                   21.5638
_cell_volume                     349.061
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Friese_ZEKRDZ_2003_1778.cif
_cod_data_source_block           H2Br3Li5O2
_cod_original_cell_volume        349.0606
_cod_original_formula_sum        'H2 Br3 Li5 O2'
_cod_database_code               8103749
Dynamics of anions and cations in cesium hydrogensulfide (Cs H S, Cs D S): neutron and X-ray diffraction, calorimetry and proton NMR investigations
Haarmann, F.; Jacobs, H.; White, M.A.; Kockelmann, W.; Marriott, R.A.; Mueller, P.; Kennedy, C.A.; Senker, J.; Qiu, L.; Journal of Chemical Physics 117 (2002) 4961–4972; doi:

data_1531491
_publ_section_title
;
 Dynamics of anions and cations in cesium hydrogensulfide (Cs H S, Cs D
 S): neutron and X-ray diffraction, calorimetry and proton NMR
 investigations
;
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              4961
_journal_page_last               4972
_journal_volume                  117
_journal_year                    2002
_chemical_formula_sum            'Cs D S'
_chemical_name_systematic        'Cs (D S)'
_space_group_IT_number           87
_symmetry_space_group_name_Hall  '-I 4'
_symmetry_space_group_name_H-M   'I 4/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.202
_cell_length_b                   8.202
_cell_length_c                   9.0245
_cell_volume                     607.103
_citation_journal_id_ASTM        JCPSA6
_cod_data_source_file            Haarmann_JCPSA6_2002_1950.cif
_cod_data_source_block           D1Cs1S1
_cod_original_cell_volume        607.1033
_cod_original_formula_sum        'D1 Cs1 S1'
_cod_database_code               1531491
Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ti und A = Rb, Cs
Hofmann, B.; Zeitschrift fuer Anorganische und Allgemeine Chemie 458 (1979) 151–162; doi:

data_1531492
_publ_section_title
;
 Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ti und A = Rb, Cs
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              151
_journal_page_last               162
_journal_volume                  458
_journal_year                    1979
_chemical_formula_sum            'F7 Rb3 Si'
_chemical_name_systematic        'Rb3 Si F7'
_space_group_IT_number           127
_symmetry_space_group_name_Hall  '-P 4 2ab'
_symmetry_space_group_name_H-M   'P 4/m b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.959
_cell_length_b                   7.959
_cell_length_c                   5.823
_cell_volume                     368.862
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hofmann_ZAACAB_1979_1077.cif
_cod_data_source_block           F7Rb3Si1
_cod_original_cell_volume        368.8619
_cod_original_formula_sum        'F7 Rb3 Si1'
_cod_database_code               1531492
Crystal structure determination of systematically intergrown compounds: Li5 (O H)2 Br3 and Li2 (O H) Br
Friese, K.; Hoennerscheid, A.; Jansen, M.; Zeitschrift fuer Kristallographie (149,1979-) 218 (2003) 536–541; doi:

data_8103750
_publ_section_title
;
 Crystal structure determination of systematically intergrown compounds:
 Li5 (O H)2 Br3 and Li2 (O H) Br
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              536
_journal_page_last               541
_journal_volume                  218
_journal_year                    2003
_chemical_formula_sum            'Br H Li2 O'
_chemical_name_systematic        'Li2 (O H) Br'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.04594
_cell_length_b                   4.04594
_cell_length_c                   4.04594
_cell_volume                     66.231
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Friese_ZEKRDZ_2003_1780.cif
_cod_data_source_block           H1Br1Li2O1
_cod_original_cell_volume        66.23054
_cod_original_formula_sum        'H1 Br1 Li2 O1'
_cod_database_code               8103750
Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ni und A = Rb, Cs
Hofmann, B.; Zeitschrift fuer Anorganische und Allgemeine Chemie 458 (1979) 151–162; doi:

data_1531493
_publ_section_title
;
 Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ni und A = Rb, Cs
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              151
_journal_page_last               162
_journal_volume                  458
_journal_year                    1979
_chemical_formula_sum            'Cs2 F7 Rb Si'
_chemical_name_systematic        'Cs2 Rb Si F7'
_space_group_IT_number           127
_symmetry_space_group_name_Hall  '-P 4 2ab'
_symmetry_space_group_name_H-M   'P 4/m b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.1989
_cell_length_b                   8.1989
_cell_length_c                   6.019
_cell_volume                     404.609
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hofmann_ZAACAB_1979_1089.cif
_cod_data_source_block           Cs2F7Rb1Si1
_cod_original_formula_sum        'Cs2 F7 Rb1 Si1'
_cod_database_code               1531493
The crystal structure of Ba Bi4 Ti4 O15
Fuentes, M.E.; Fernandez, J.F.; Mehta, A.; Lascano, L.; Chianelli, R.R.; Fuentes, L.; Camacho, H.; Ferroelectrics 269 (2002) 159–164; doi:

data_1531494
_publ_section_title
;
 The crystal structure of Ba Bi4 Ti4 O15
;
_journal_name_full               Ferroelectrics
_journal_page_first              159
_journal_page_last               164
_journal_volume                  269
_journal_year                    2002
_chemical_formula_sum            'Ba Bi4 O15 Ti4'
_chemical_name_systematic        'Ba Bi4 Ti4 O15'
_space_group_IT_number           42
_symmetry_space_group_name_Hall  'F 2 -2'
_symmetry_space_group_name_H-M   'F m m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   41.857
_cell_length_b                   5.4551
_cell_length_c                   5.468
_cell_volume                     1248.531
_citation_journal_id_ASTM        FEROA8
_cod_data_source_file            Fuentes_FEROA8_2002_1681.cif
_cod_data_source_block           Ba1Bi4O15Ti4
_cod_original_formula_sum        'Ba1 Bi4 O15 Ti4'
_cod_database_code               1531494
Dynamics of anions and cations in cesium hydrogensulfide (Cs H S, Cs D S): neutron and X-ray diffraction, calorimetry and proton NMR investigations
Haarmann, F.; Jacobs, H.; Kennedy, C.A.; Kockelmann, W.; Senker, J.; Mueller, P.; Marriott, R.A.; Qiu, L.; White, M.A.; Journal of Chemical Physics 117 (2002) 4961–4972; doi:

data_1531495
_publ_section_title
;
 Dynamics of anions and cations in cesium hydrogensulfide (Cs H S, Cs D
 S): neutron and X-ray diffraction, calorimetry and proton NMR
 investigations
;
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              4961
_journal_page_last               4972
_journal_volume                  117
_journal_year                    2002
_chemical_formula_sum            'Cs D S'
_chemical_name_systematic        'Cs (D S)'
_space_group_IT_number           127
_symmetry_space_group_name_Hall  '-P 4 2ab'
_symmetry_space_group_name_H-M   'P 4/m b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.8465
_cell_length_b                   5.8465
_cell_length_c                   4.5259
_cell_volume                     154.702
_citation_journal_id_ASTM        JCPSA6
_cod_data_source_file            Haarmann_JCPSA6_2002_1952.cif
_cod_data_source_block           D1Cs1S1
_cod_original_cell_volume        154.7023
_cod_original_formula_sum        'D1 Cs1 S1'
_cod_database_code               1531495
Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ni und A = Rb, Cs
Hofmann, B.; Zeitschrift fuer Anorganische und Allgemeine Chemie 458 (1979) 151–162; doi:

data_1531496
_publ_section_title
;
 Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ni und A = Rb, Cs
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              151
_journal_page_last               162
_journal_volume                  458
_journal_year                    1979
_chemical_formula_sum            'Cs2 F7 K Si'
_chemical_name_systematic        'Cs2 K Si F7'
_space_group_IT_number           127
_symmetry_space_group_name_Hall  '-P 4 2ab'
_symmetry_space_group_name_H-M   'P 4/m b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.115
_cell_length_b                   8.115
_cell_length_c                   5.972
_cell_volume                     393.275
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hofmann_ZAACAB_1979_1100.cif
_cod_data_source_block           Cs2F7K1Si1
_cod_original_cell_volume        393.2755
_cod_original_formula_sum        'Cs2 F7 K1 Si1'
_cod_database_code               1531496
Structural analysis of several W(VI) and Mo(VI) complex perovskites prepared by the polymeric precursors method
Fuentes, A.F.; Boulahya, K.; Hernandez-Ibarra, O.; Amador, U.; Mendoza-Suarez, G.; Escalante-Garcia, J.I.; Journal of Solid State Chemistry 173 (2003) 319–327; doi:

data_1531497
_publ_section_title
;
 Structural analysis of several W(VI) and Mo(VI) complex perovskites
 prepared by the polymeric precursors method
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              319
_journal_page_last               327
_journal_volume                  173
_journal_year                    2003
_chemical_formula_sum            'Ba In0.667 Mo0.333 O3'
_chemical_name_systematic        'Ba (In0.667 Mo0.333) O3'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.16606
_cell_length_b                   4.16606
_cell_length_c                   4.16606
_cell_volume                     72.306
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Fuentes_JSSCBI_2003_1596.cif
_cod_data_source_block           Ba1In0.667Mo0.333O3
_cod_original_cell_volume        72.30637
_cod_original_formula_sum        'Ba1 In0.667 Mo0.333 O3'
_cod_database_code               1531497
Dynamics of anions and cations in cesium hydrogensulfide (Cs H S, Cs D S): neutron and X-ray diffraction, calorimetry and proton NMR investigations
Haarmann, F.; Jacobs, H.; White, M.A.; Kockelmann, W.; Senker, J.; Mueller, P.; Marriott, R.A.; Kennedy, C.A.; Qiu, L.; Journal of Chemical Physics 117 (2002) 4961–4972; doi:

data_1531498
_publ_section_title
;
 Dynamics of anions and cations in cesium hydrogensulfide (Cs H S, Cs D
 S): neutron and X-ray diffraction, calorimetry and proton NMR
 investigations
;
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              4961
_journal_page_last               4972
_journal_volume                  117
_journal_year                    2002
_chemical_formula_sum            'Cs D S'
_chemical_name_systematic        'Cs (D S)'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.3271
_cell_length_b                   4.3271
_cell_length_c                   4.3271
_cell_volume                     81.020
_citation_journal_id_ASTM        JCPSA6
_cod_data_source_file            Haarmann_JCPSA6_2002_1953.cif
_cod_data_source_block           D1Cs1S1
_cod_original_cell_volume        81.01972
_cod_original_formula_sum        'D1 Cs1 S1'
_cod_database_code               1531498
Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ni und A = Rb, Cs
Hofmann, B.; Zeitschrift fuer Anorganische und Allgemeine Chemie 458 (1979) 151–162; doi:

data_1531499
_publ_section_title
;
 Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ni und A = Rb, Cs
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              151
_journal_page_last               162
_journal_volume                  458
_journal_year                    1979
_chemical_formula_sum            'Cs F7 Rb2 Si'
_chemical_name_systematic        'Rb2 Cs Si F7'
_space_group_IT_number           127
_symmetry_space_group_name_Hall  '-P 4 2ab'
_symmetry_space_group_name_H-M   'P 4/m b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.099
_cell_length_b                   8.099
_cell_length_c                   5.899
_cell_volume                     386.938
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hofmann_ZAACAB_1979_1109.cif
_cod_data_source_block           Cs1F7Rb2Si1
_cod_original_cell_volume        386.9378
_cod_original_formula_sum        'Cs1 F7 Rb2 Si1'
_cod_database_code               1531499
Structural analysis of several W(VI) and Mo(VI) complex perovskitesprepared by the polymeric precursors method
Fuentes, A.F.; Boulahya, K.; Hernandez-Ibarra, O.; Mendoza-Suarez, G.; Amador, U.; Escalante-Garcia, J.I.; Journal of Solid State Chemistry 173 (2003) 319–327; doi:

data_1531500
_publ_section_title
;
 Structural analysis of several W(VI) and Mo(VI) complex
 perovskitesprepared by the polymeric precursors method
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              319
_journal_page_last               327
_journal_volume                  173
_journal_year                    2003
_chemical_formula_sum            'Ba In0.667 O3 W0.333'
_chemical_name_systematic        'Ba (In0.667 W0.333) O3'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.315
_cell_length_b                   8.315
_cell_length_c                   8.315
_cell_volume                     574.893
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Fuentes_JSSCBI_2003_1597.cif
_cod_data_source_block           Ba1In0.667O3W0.333
_cod_original_cell_volume        574.8926
_cod_original_formula_sum        'Ba1 In0.667 O3 W0.333'
_cod_database_code               1531500
Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ni und A = Rb, Cs
Hofmann, B.; Zeitschrift fuer Anorganische und Allgemeine Chemie 458 (1979) 151–162; doi:

data_1531501
_publ_section_title
;
 Neue Metallfluoride A3 M F7 mit M = Si, Ti, Cr, Mn, Ni und A = Rb, Cs
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              151
_journal_page_last               162
_journal_volume                  458
_journal_year                    1979
_chemical_formula_sum            'F7 K Rb2 Si'
_chemical_name_systematic        'Rb2 K Si F7'
_space_group_IT_number           127
_symmetry_space_group_name_Hall  '-P 4 2ab'
_symmetry_space_group_name_H-M   'P 4/m b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.883
_cell_length_b                   7.883
_cell_length_c                   5.724
_cell_volume                     355.699
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hofmann_ZAACAB_1979_1114.cif
_cod_data_source_block           F7K1Rb2Si1
_cod_original_formula_sum        'F7 K1 Rb2 Si1'
_cod_database_code               1531501
Structural analysis of several W(VI) and Mo(VI) complex perovskitesprepared by the polymeric precursors method
Fuentes, A.F.; Hernandez-Ibarra, O.; Mendoza-Suarez, G.; Amador, U.; Boulahya, K.; Escalante-Garcia, J.I.; Journal of Solid State Chemistry 173 (2003) 319–327; doi:

data_1531502
_publ_section_title
;
 Structural analysis of several W(VI) and Mo(VI) complex
 perovskitesprepared by the polymeric precursors method
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              319
_journal_page_last               327
_journal_volume                  173
_journal_year                    2003
_chemical_formula_sum            'Ba In0.667 O3 W0.333'
_chemical_name_systematic        'Ba (In0.667 W0.333) O3'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.1573
_cell_length_b                   4.1573
_cell_length_c                   4.1573
_cell_volume                     71.851
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Fuentes_JSSCBI_2003_1598.cif
_cod_data_source_block           Ba1In0.667O3W0.333
_cod_original_cell_volume        71.85121
_cod_original_formula_sum        'Ba1 In0.667 O3 W0.333'
_cod_database_code               1531502
Zur Kenntnis von Calciumtetrahydrogen-hexaoxo- diperiodattetrahydrat Ca H4 I2 O10 * 4(H2 O): Kristallstruktur, Schwingungsspektren und thermische Analyse
Haeuseler, H.; Botova, M.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 57 (2002) 1337–1345; doi:

data_7222178
_publ_section_title
;
 Zur Kenntnis von Calciumtetrahydrogen-hexaoxo- diperiodattetrahydrat Ca
 H4 I2 O10 * 4(H2 O): Kristallstruktur, Schwingungsspektren und thermische
 Analyse
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              1337
_journal_page_last               1345
_journal_volume                  57
_journal_year                    2002
_chemical_formula_sum            'Ca H12 I2 O14'
_chemical_name_systematic        'Ca (H4 I2 O10) (H2 O)4'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 120.62
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   19.866
_cell_length_b                   5.642
_cell_length_c                   11.494
_cell_volume                     1108.659
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Haeuseler_ZNBSEN_2002_1086.cif
_cod_data_source_block           H12Ca1I2O14
_cod_original_formula_sum        'H12 Ca1 I2 O14'
_cod_database_code               7222178