LMucko/crystallography-open-database huggingface dataset:
An analysis of crystal structure of Ca-deficient oxonitridoaluminosilicate, Ca0.88Al0.91Si1.09N2.85O0.15
Uheda, K.; Yamamoto, H.; Yamane, H.; Inami, W.; Tsuda, K.; Yamamoto, Y.; Hirosaki, N.; Journal of the Ceramic Society of Japan 117 (2009) 94–98; doi:

data_1544503
_publ_section_title
;
 An analysis of crystal structure of Ca-deficient
 oxonitridoaluminosilicate, Ca0.88Al0.91Si1.09N2.85O0.15
;
_journal_name_full               'Journal of the Ceramic Society of Japan'
_journal_page_first              94
_journal_page_last               98
_journal_volume                  117
_journal_year                    2009
_chemical_formula_sum            'Al0.91 Ca0.88 N2.85 O0.15 Si1.09'
_chemical_name_common            Ca0.88Al0.91Si1.09N2.85O0.15
_space_group_IT_number           36
_space_group_name_H-M_alt        'C m c 21'
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.8020(4)
_cell_length_b                   5.6506(2)
_cell_length_c                   5.0633(2)
_cell_volume                     280.442(19)
_cod_data_source_file            Ca0.88Al0.91Si1.09N2.85O0.15.cif
_cod_data_source_block           CaAlSiN3
_cod_original_formula_sum        'Ca0.88 Al0.91 Si1.09 N2.85 O0.15'
_cod_database_code               1544503
High-pressure synthesis and characterization of a novel perovskite PbFe1/2V1/2O3
Tsuchiya, T.; Katsumata, T.; Ohba, T.; Inaguma, Y.; Journal of the Ceramic Society of Japan 117 (2009) 102–105; doi:

data_1544504
_publ_section_title
;
 High-pressure synthesis and characterization of a novel perovskite
 PbFe1/2V1/2O3
;
_journal_name_full               'Journal of the Ceramic Society of Japan'
_journal_page_first              102
_journal_page_last               105
_journal_volume                  117
_journal_year                    2009
_chemical_formula_sum            'Fe0.5 O3 Pb V0.5'
_chemical_name_common            PbFe0.5V0.5O3
_space_group_IT_number           99
_space_group_name_H-M_alt        'P 4 m m'
_symmetry_space_group_name_Hall  'P 4 -2'
_symmetry_space_group_name_H-M   'P 4 m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.8034(2)
_cell_length_b                   3.8034(2)
_cell_length_c                   4.5097(3)
_cell_volume                     65.237(7)
_cod_data_source_file            PbFe0.5V0.5O3.cif
_cod_data_source_block           PbFe0.5V0.5O3
_cod_original_formula_sum        'Pb Fe0.5 V0.5 O3'
_cod_database_code               1544504
Hydrothermal synthesis of a new perovskite-type bismuth oxide: Ba0.96Bi0.86O2.59(OH)0.41
Jiang, H.; Kumada, N.; Yonesaki, Y.; Takei, T.; Kinomura, N.; Journal of the Ceramic Society of Japan 117 (2009) 214–216; doi:

data_1544505
_publ_section_title
;
 Hydrothermal synthesis of a new perovskite-type bismuth oxide:
 Ba0.96Bi0.86O2.59(OH)0.41
;
_journal_name_full               'Journal of the Ceramic Society of Japan'
_journal_page_first              214
_journal_page_last               216
_journal_volume                  117
_journal_year                    2009
_chemical_formula_sum            'Ba0.96 Bi0.86 H0.41 O3'
_chemical_name_common            Ba0.96Bi0.86O2.59(OH)0.41
_space_group_IT_number           221
_space_group_name_H-M_alt        'P m -3 m'
_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                   4.2995(5)
_cell_length_b                   4.2995(5)
_cell_length_c                   4.2995(5)
_cell_volume                     79.479(16)
_cod_data_source_file            BaBiO3.cif
_cod_data_source_block           BaBiO3
_cod_original_formula_sum        'Ba0.96 Bi0.86 O3 H0.41'
_cod_database_code               1544505
Preparation and crystal structure of two types of zirconium phosphates by hydrothermal reaction
Kumada, N.; Hinata, J.; Dong, Q.; Yonesaki, Y.; Takei, T.; Kinomura, N.; Journal of the Ceramic Society of Japan 119 (2011) 412–416; doi:

data_1544506
_publ_section_title
;
 Preparation and crystal structure of two types of zirconium phosphates by
 hydrothermal reaction
;
_journal_name_full               'Journal of the Ceramic Society of Japan'
_journal_page_first              412
_journal_page_last               416
_journal_volume                  119
_journal_year                    2011
_chemical_formula_sum            'H11 N2 O14 P3 Zr2'
_chemical_name_common            (NH4)2[Zr2(OH)2(PO4)2(HPO4)]
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 1 2/c 1'
_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                 103.69(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   17.093(4)
_cell_length_b                   8.748(2)
_cell_length_c                   9.216(2)
_cell_volume                     1338.9(5)
_cod_data_source_file            ZrPO-6.cif
_cod_data_source_block           H11Zr2P3N2O14
_cod_original_formula_sum        'H11 Zr2 P3 N2 O14'
_cod_database_code               1544506
Preparation and crystal structure of two types of zirconium phosphates by hydrothermal reaction
Kumada, N.; Hinata, J.; Dong, Q.; Yonesaki, Y.; Takei, T.; Kinomura, N.; Journal of the Ceramic Society of Japan 119 (2011) 412–416; doi:

data_1544507
_publ_section_title
;
 Preparation and crystal structure of two types of zirconium phosphates by
 hydrothermal reaction
;
_journal_name_full               'Journal of the Ceramic Society of Japan'
_journal_page_first              412
_journal_page_last               416
_journal_volume                  119
_journal_year                    2011
_chemical_formula_sum            'H4 N O12 P3 Zr2'
_chemical_name_common            (NH4)Zr2(PO4)3
_space_group_IT_number           198
_space_group_name_H-M_alt        'P 21 3'
_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                   10.198(1)
_cell_length_b                   10.198(1)
_cell_length_c                   10.198(1)
_cell_volume                     1060.58(18)
_cod_data_source_file            ZrPO-7.cif
_cod_data_source_block           H4Zr2P3NO12
_cod_original_formula_sum        'H4 Zr2 P3 N O12'
_cod_database_code               1544507
Preparation and crystal structure of [enH2]0.5[Ho(HPO4)(SO4)(H2O)] (en; ethylenediamine)
Kumada, N.; Kumon, J.; Miyagawa, K.; Yonesaki, Y.; Takei, T.; Kinomura, N.; Wang, D.; Yu, R.; Journal of the Ceramic Society of Japan 118 (2010) 236–240; doi:

data_1544509
_publ_section_title
;
 Preparation and crystal structure of [enH2]0.5[Ho(HPO4)(SO4)(H2O)] (en;
 ethylenediamine)
;
_journal_name_full               'Journal of the Ceramic Society of Japan'
_journal_page_first              236
_journal_page_last               240
_journal_volume                  118
_journal_year                    2010
_chemical_formula_sum            'C H8 Ho N O9 P S'
_chemical_name_common            HoPSO9H8NC
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/a 1'
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 88.12(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.938(5)
_cell_length_b                   6.834(3)
_cell_length_c                   9.100(2)
_cell_volume                     804.2(5)
_cod_data_source_file            HoPSO9H8NC.cif
_cod_data_source_block           HoPSO9H8NC
_cod_original_formula_sum        'Ho P S O9 H8 N C'
_cod_database_code               1544509
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000087
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.362267(12)
_cell_length_b                   7.510380(14)
_cell_length_c                   5.292981(11)
_cell_measurement_temperature    295
_cell_volume                     213.1624(8)
_diffrn_ambient_temperature      295
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.910
_cod_database_code               3000087
_cod_hold_until_date             2017-04-07
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000088
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.368338(14)
_cell_length_b                   7.520568(15)
_cell_length_c                   5.300603(11)
_cell_measurement_temperature    403
_cell_volume                     214.0010(8)
_diffrn_ambient_temperature      403
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.866
_cod_database_code               3000088
_cod_hold_until_date             2017-04-07
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000089
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.383488(15)
_cell_length_b                   7.536317(14)
_cell_length_c                   5.312201(12)
_cell_measurement_temperature    507
_cell_volume                     215.5249(9)
_diffrn_ambient_temperature      507
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.858
_cod_database_code               3000089
_cod_hold_until_date             2017-10-07
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000090
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.406215(15)
_cell_length_b                   7.556727(14)
_cell_length_c                   5.326876(11)
_cell_measurement_temperature    608
_cell_volume                     217.6204(9)
_diffrn_ambient_temperature      608
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.78
_cod_database_code               3000090
_cod_hold_until_date             2017-04-07
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000091
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.437758(13)
_cell_length_b                   7.584137(13)
_cell_length_c                   5.34588(1)
_cell_measurement_temperature    721
_cell_volume                     220.4678(8)
_diffrn_ambient_temperature      721
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.716
_cod_database_code               3000091
_cod_hold_until_date             2017-04-07
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000092
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.459411(1)
_cell_length_b                   7.606208(12)
_cell_length_c                   5.360822(9)
_cell_measurement_temperature    830
_cell_volume                     222.6104(5)
_diffrn_ambient_temperature      830
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.584
_cod_database_code               3000092
_cod_hold_until_date             2017-04-07
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000093
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.474805(1)
_cell_length_b                   7.624891(14)
_cell_length_c                   5.373453(11)
_cell_measurement_temperature    934
_cell_volume                     224.3137(6)
_diffrn_ambient_temperature      934
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.526
_cod_database_code               3000093
_cod_hold_until_date             2017-04-07
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000094
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.486466(1)
_cell_length_b                   7.641077(17)
_cell_length_c                   5.384421(12)
_cell_measurement_temperature    1034
_cell_volume                     225.7284(7)
_diffrn_ambient_temperature      1034
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.516
_cod_database_code               3000094
_cod_hold_until_date             2017-04-07
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000095
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.496933(11)
_cell_length_b                   7.657297(19)
_cell_length_c                   5.395592(12)
_cell_measurement_temperature    1142
_cell_volume                     227.1094(9)
_diffrn_ambient_temperature      1142
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.498
_cod_database_code               3000095
_cod_hold_until_date             2017-04-07
Structure and thermal expansion behaviour of samarium cobalt oxide
Matthew Rowles; Wang, Cheng Cheng; Chen, Kongfa; Li, Na; He, Shuai; Jiang, San-Ping; To be published in Acta Cryst. Section B  () –; doi:

data_3000096
_publ_section_title
;
 Structure and thermal expansion behaviour of samarium cobalt oxide
;
_journal_name_full               'To be published in Acta Cryst. Section B'
_chemical_formula_sum            'Co O3 Sm'
_chemical_name_mineral           'Samarium Cobalt Oxide'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.505157(13)
_cell_length_b                   7.671638(24)
_cell_length_c                   5.405593(17)
_cell_measurement_temperature    1245
_cell_volume                     228.2975(11)
_diffrn_ambient_temperature      1245
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.7993281
_refine_ls_goodness_of_fit_all   1.512
_cod_database_code               3000096
_cod_hold_until_date             2017-04-07
A(VO)2(AsO4)2 (A = Ba or Sr) : Two vanadyl(IV) arsenates containing dimers of edge-sharing VO6 octahedra
Wang, Sue-Lein; Cheng, Chih-Yi; Journal of Solid State Chemistry 109 (1994) 277–280; doi:10.1006/jssc.1994.1104

data_1544519
_publ_section_title
;
 A(VO)2(AsO4)2 (A = Ba or Sr) : Two vanadyl(IV) arsenates containing
 dimers of edge-sharing VO6 octahedra
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              277
_journal_page_last               280
_journal_paper_doi               10.1006/jssc.1994.1104
_journal_volume                  109
_journal_year                    1994
_chemical_formula_sum            'As2 Ba O10 V2'
_chemical_formula_weight         549.05
_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                   18.384(2)
_cell_length_b                   18.384(2)
_cell_length_c                   4.651(1)
_cell_volume                     1571.9(4)
_diffrn_ambient_temperature      296
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    15.683
_exptl_crystal_density_diffrn    4.640
_exptl_crystal_F_000             1984
_refine_ls_number_parameters     76
_refine_ls_number_reflns         799
_refine_ls_R_factor_gt           0.0271
_refine_ls_wR_factor_gt          0.0310
_cod_data_source_file            JSSC-1994-109-277-280-1.cif
_cod_data_source_block           Ba
_cod_depositor_comments
;
The following automatic conversions were performed:

'_journal_paper_doi' value 'http://dx.doi.org/10.1006/jssc.1994.1104'
was changed to '10.1006/jssc.1994.1104'.

Automatic conversion script
Id: cif_fix_values 6433 2018-09-21 13:16:33Z andrius 
;
_cod_original_cell_volume        1571.9(5)
_cod_original_sg_symbol_H-M      'I 41/a'
_cod_database_code               1544519
A(VO)2(AsO4)2 (A = Ba or Sr) : Two vanadyl(IV) arsenates containing dimers of edge-sharing VO6 octahedra
Wang, Sue-Lein; Cheng, Chih-Yi; Journal of Solid State Chemistry 109 (1994) 277–280; doi:10.1006/jssc.1994.1104

data_1544520
_publ_section_title
;
 A(VO)2(AsO4)2 (A = Ba or Sr) : Two vanadyl(IV) arsenates containing
 dimers of edge-sharing VO6 octahedra
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              277
_journal_page_last               280
_journal_paper_doi               10.1006/jssc.1994.1104
_journal_volume                  109
_journal_year                    1994
_chemical_formula_sum            'As2 O10 Sr V2'
_chemical_formula_weight         499.3
_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                   18.131(5)
_cell_length_b                   18.131(5)
_cell_length_c                   4.669(1)
_cell_volume                     1534.9(7)
_diffrn_ambient_temperature      296
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    17.911
_exptl_crystal_density_diffrn    4.322
_exptl_crystal_F_000             1840
_refine_ls_number_parameters     76
_refine_ls_number_reflns         630
_refine_ls_R_factor_gt           0.0338
_refine_ls_wR_factor_gt          0.0319
_cod_data_source_file            JSSC-1994-109-277-280-2.cif
_cod_data_source_block           Sr
_cod_depositor_comments
;
The following automatic conversions were performed:

'_journal_paper_doi' value 'http://dx.doi.org/10.1006/jssc.1994.1104'
was changed to '10.1006/jssc.1994.1104'.

Automatic conversion script
Id: cif_fix_values 6433 2018-09-21 13:16:33Z andrius 
;
_cod_original_cell_volume        1534.9(9)
_cod_original_sg_symbol_H-M      'I 41/a'
_cod_database_code               1544520