LMucko/crystallography-open-database huggingface dataset:
Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ}
Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V.; Acta Crystallographica Section B 71 (2015) 455–462; doi:10.1107/S2052520615010203

data_2106645
_publ_section_title
;
 Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~\d}
;
_journal_coeditor_code           ZB5046
_journal_issue                   4
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              455
_journal_page_last               462
_journal_paper_doi               10.1107/S2052520615010203
_journal_volume                  71
_journal_year                    2015
_chemical_formula_sum            'Ba0.56 Ce0.886 O3 Pr0.44'
_chemical_formula_weight         311.05
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   6.18949(7)
_cell_length_b                   8.74009(9)
_cell_length_c                   6.21421(9)
_cell_measurement_temperature    298(1)
_cell_volume                     336.168(7)
_diffrn_ambient_temperature      298(1)
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     1.240143
_exptl_absorpt_coefficient_mu    89.4
_exptl_crystal_density_diffrn    6.146
_exptl_crystal_description       powder
_pd_block_id                     x_=_0.8_Model_I_10000_eV
_cod_data_source_file            zb5046sup1.cif
_cod_data_source_block           x_=_0.8_Model_I_10000_eV
_cod_original_cell_volume        336.168(1)
_cod_database_code               2106645
Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ}
Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V.; Acta Crystallographica Section B 71 (2015) 455–462; doi:10.1107/S2052520615010203

data_2106646
_publ_section_title
;
 Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~\d}
;
_journal_coeditor_code           ZB5046
_journal_issue                   4
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              455
_journal_page_last               462
_journal_paper_doi               10.1107/S2052520615010203
_journal_volume                  71
_journal_year                    2015
_chemical_formula_sum            'Ba0.56 Ce0.886 O3 Pr0.44'
_chemical_formula_weight         311.05
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   6.18949(7)
_cell_length_b                   8.74009(9)
_cell_length_c                   6.21421(9)
_cell_measurement_temperature    298(1)
_cell_volume                     336.168(7)
_diffrn_ambient_temperature      298(1)
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     2.079411
_exptl_absorpt_coefficient_mu    173.1
_exptl_crystal_density_diffrn    6.146
_exptl_crystal_description       powder
_pd_block_id                     x_=_0.8_Model_I_5962_eV
_cod_data_source_file            zb5046sup1.cif
_cod_data_source_block           x_=_0.8_Model_I_5962_eV
_cod_original_cell_volume        336.168(1)
_cod_database_code               2106646
Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ}
Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V.; Acta Crystallographica Section B 71 (2015) 455–462; doi:10.1107/S2052520615010203

data_2106647
_publ_section_title
;
 Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~\d}
;
_journal_coeditor_code           ZB5046
_journal_issue                   4
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              455
_journal_page_last               462
_journal_paper_doi               10.1107/S2052520615010203
_journal_volume                  71
_journal_year                    2015
_chemical_formula_sum            'Ba Ce0.2 O3 Pr0.8'
_chemical_formula_weight         326.09
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   6.18949(7)
_cell_length_b                   8.74009(9)
_cell_length_c                   6.21421(9)
_cell_measurement_temperature    298(1)
_cell_volume                     336.168(7)
_diffrn_ambient_temperature      298(1)
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     1.240143
_exptl_absorpt_coefficient_mu    91.3
_exptl_crystal_density_diffrn    6.443
_exptl_crystal_description       powder
_pd_block_id                     x_=_0.8_Model_II_10000_eV
_cod_data_source_file            zb5046sup1.cif
_cod_data_source_block           x_=_0.8_Model_II_10000_eV
_cod_original_cell_volume        336.168(1)
_cod_database_code               2106647
Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ}
Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V.; Acta Crystallographica Section B 71 (2015) 455–462; doi:10.1107/S2052520615010203

data_2106648
_publ_section_title
;
 Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~\d}
;
_journal_coeditor_code           ZB5046
_journal_issue                   4
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              455
_journal_page_last               462
_journal_paper_doi               10.1107/S2052520615010203
_journal_volume                  71
_journal_year                    2015
_chemical_formula_sum            'Ba Ce0.2 O3 Pr0.8'
_chemical_formula_weight         326.09
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   6.18949(7)
_cell_length_b                   8.74009(9)
_cell_length_c                   6.21421(9)
_cell_measurement_temperature    298(1)
_cell_volume                     336.168(7)
_diffrn_ambient_temperature      298(1)
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     2.079411
_exptl_absorpt_coefficient_mu    181.5
_exptl_crystal_density_diffrn    6.443
_exptl_crystal_description       powder
_pd_block_id                     x_=_0.8_Model_II_5962_eV
_cod_data_source_file            zb5046sup1.cif
_cod_data_source_block           x_=_0.8_Model_II_5962_eV
_cod_original_cell_volume        336.168(1)
_cod_database_code               2106648
Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ}
Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V.; Acta Crystallographica Section B 71 (2015) 455–462; doi:10.1107/S2052520615010203

data_2106649
_publ_section_title
;
 Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~\d}
;
_journal_coeditor_code           ZB5046
_journal_issue                   4
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              455
_journal_page_last               462
_journal_paper_doi               10.1107/S2052520615010203
_journal_volume                  71
_journal_year                    2015
_chemical_formula_sum            'Ba0.99 Ce0.2 O3 Pr0.79'
_chemical_formula_weight         321.91
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   6.18949(7)
_cell_length_b                   8.74009(9)
_cell_length_c                   6.21421(9)
_cell_measurement_temperature    298(1)
_cell_volume                     336.168(7)
_diffrn_ambient_temperature      298(1)
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     1.240143
_exptl_absorpt_coefficient_mu    91.3
_exptl_crystal_density_diffrn    6.361
_exptl_crystal_description       powder
_pd_block_id                     x_=_0.8_Model_III_10000_eV
_cod_data_source_file            zb5046sup1.cif
_cod_data_source_block           x_=_0.8_Model_III_10000_eV
_cod_original_cell_volume        336.168(1)
_cod_database_code               2106649
Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~δ}
Basbus, Juan F.; Caneiro, Alberto; Suescun, Leopoldo; Lamas, Diego G.; Mogni, Liliana V.; Acta Crystallographica Section B 71 (2015) 455–462; doi:10.1107/S2052520615010203

data_2106650
_publ_section_title
;
 Anomalous X-ray diffraction study of Pr-substituted BaCeO~3{-~\d}
;
_journal_coeditor_code           ZB5046
_journal_issue                   4
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              455
_journal_page_last               462
_journal_paper_doi               10.1107/S2052520615010203
_journal_volume                  71
_journal_year                    2015
_chemical_formula_sum            'Ba0.99 Ce0.2 O3 Pr0.79'
_chemical_formula_weight         321.91
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   6.18949(7)
_cell_length_b                   8.74009(9)
_cell_length_c                   6.21421(9)
_cell_measurement_temperature    298(1)
_cell_volume                     336.168(7)
_diffrn_ambient_temperature      298(1)
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     2.079411
_exptl_absorpt_coefficient_mu    179.1
_exptl_crystal_density_diffrn    6.361
_exptl_crystal_description       powder
_pd_block_id                     x_=_0.8_Model_III_5962_eV
_cod_data_source_file            zb5046sup1.cif
_cod_data_source_block           x_=_0.8_Model_III_5962_eV
_cod_original_cell_volume        336.168(1)
_cod_database_code               2106650
Zero Thermal Expansion in ZrMgMo3O12: NMR Crystallography Reveals Origins of Thermoelastic Properties
Romao, Carl P.; Perras, Frédéric A.; Werner-Zwanziger, Ulrike; Lussier, Joey A.; Miller, Kimberly J.; Calahoo, Courtney M.; Zwanziger, Josef W.; Bieringer, Mario; Marinkovic, Bojan A.; Bryce, David L.; White, Mary Anne; Chemistry of Materials 27 (2015) 2633–2646; doi:10.1021/acs.chemmater.5b00429

data_4002451
_publ_section_title
;
 Zero Thermal Expansion in ZrMgMo3O12: NMR Crystallography Reveals
 Origins of Thermoelastic Properties
;
_journal_issue                   7
_journal_name_full               'Chemistry of Materials'
_journal_page_first              2633
_journal_page_last               2646
_journal_paper_doi               10.1021/acs.chemmater.5b00429
_journal_volume                  27
_journal_year                    2015
_chemical_formula_sum            'Mg Mo3 O12 Zr'
_chemical_formula_weight         595.35
_chemical_name_common            'Zirconium Magnesium Molybdate'
_space_group_IT_number           33
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90.0000
_cell_angle_beta                 90.0000
_cell_angle_gamma                90.0000
_cell_formula_units_Z            4
_cell_length_a                   9.5736(2)
_cell_length_b                   9.4900(2)
_cell_length_c                   13.1739(3)
_cell_measurement_temperature    298
_cell_volume                     1196.89(4)
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Cu K\a~1~,K\a~2~'
_diffrn_radiation_xray_symbol    'K-L~2,3~'
_exptl_crystal_description       powder
_cod_data_source_file            ZrMgMo3O12_pub.cif
_cod_data_source_block           ZrMgMo3O12
_cod_database_code               4002451
Photoluminescence Tuning via Cation Substitution in Oxonitridosilicate Phosphors: DFT Calculations, Different Site Occupations, and Luminescence Mechanisms
Guogang Li; Chun Che Lin; Wei-Ting Chen; Maxim S. Molokeev; Victor V. Atuchin; Chang-Yang Chiang; Wuzong Zhou; Chin-Wei Wang; Wen-Hsien Li; Hwo-Shuenn Sheu; Ting-Shan Chan; ChongGeng Ma; Ru-Shi Liu; Chemistry of Materials 26 (2014) 2991–; doi:10.1021/cm500844v

data_4002452
_publ_section_title
;
 Photoluminescence Tuning via Cation Substitution in Oxonitridosilicate
 Phosphors: DFT Calculations, Different Site Occupations, and Luminescence
 Mechanisms
;
_journal_issue                   9
_journal_name_full               'Chemistry of Materials'
_journal_page_first              2991
_journal_paper_doi               10.1021/cm500844v
_journal_volume                  26
_journal_year                    2014
_chemical_formula_moiety         '2(N4 O4 Si4), 3(Ba), Sr'
_chemical_formula_sum            'Ba3 N8 O8 Si8 Sr'
_chemical_formula_weight         964.41
_space_group_IT_number           1
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                89.867(14)
_cell_angle_beta                 89.885(16)
_cell_angle_gamma                90.000(12)
_cell_formula_units_Z            1
_cell_length_a                   4.79674(49)
_cell_length_b                   5.47004(50)
_cell_length_c                   14.2965(21)
_cell_measurement_temperature    300
_cell_volume                     375.11(8)
_diffrn_ambient_temperature      300
_diffrn_measurement_device_type
;
D8 ADVANCE Bruker
;
_diffrn_radiation_monochromator  none
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type
;
 Cu K\a~1~~2~
;
_exptl_absorpt_coefficient_mu    71.733
_exptl_crystal_density_diffrn    4.268843
_pd_char_colour
;
colourless
;
_pd_meas_2theta_range_inc        0.05
_pd_meas_2theta_range_max        163.8008
_pd_meas_2theta_range_min        5.4507
_pd_meas_scan_method             step
_pd_proc_ls_pref_orient_corr
;
Anisotropic model of PO. Spherical harmonics 8 ordrer.
 Jarvinen (1993). Application of symmetrized harmonics expansion to correction
of the preferred orientation effect. - J. Appl. Cryst. 26 p525-531.
;
_pd_proc_ls_profile_function     PearsonVII
_pd_proc_ls_prof_R_factor        3.695
_pd_proc_ls_prof_wR_expected     3.655
_pd_proc_ls_prof_wR_factor       4.768
_pd_proc_number_of_points        3167.002
_pd_spec_mount_mode              reflection
_refine_ls_goodness_of_fit_ref   1.304
_refine_ls_R_I_factor            1.379
_refine_ls_shift/su_max          0.01000
_cod_data_source_file            Ba0p75Sr0p25Si2N2O2.cif
_cod_data_source_block           a
_cod_original_cell_volume        375.115(76)
_cod_original_sg_symbol_Hall
;
P 1
;
_cod_original_sg_symbol_H-M      P1
_cod_original_formula_sum
;
Ba3 N8 O8 Si8 Sr
;
_cod_database_code               4002452
_cod_database_fobs_code          4002452
Crystal and magnetic structures, phase transitions in quasi-one-dimensional pyroxenes Na0.5Li0.5FeGe2O6
T.V. Drokina; G.A. Petrakovskii; M.S. Molokeev; S.V. Misyul; V.S. Bondarev; D.A. Velikanov; M. Frontzek; J. Schefer; Journal of Magnetism and Magnetic Materials 385 (2015) 243–249; doi:10.1016/j.jmmm.2015.03.016

data_1529319
_publ_section_title
;
 Crystal and magnetic structures, phase transitions in
 quasi-one-dimensional pyroxenes Na0.5Li0.5FeGe2O6
;
_journal_issue                   0
_journal_name_full               'Journal of Magnetism and Magnetic Materials'
_journal_page_first              243
_journal_page_last               249
_journal_paper_doi               10.1016/j.jmmm.2015.03.016
_journal_volume                  385
_journal_year                    2015
_chemical_formula_moiety         '2(Fe Ge2 O6), 2(Li0.50 Na0.50)'
_chemical_formula_sum            'Fe2 Ge4 Li Na O12'
_chemical_formula_weight         624.07
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_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                 108.92143(99)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   10.03328(13)
_cell_length_b                   8.81362(11)
_cell_length_c                   5.529646(90)
_cell_measurement_temperature    300
_cell_volume                     462.561(12)
_diffrn_ambient_temperature      300
_diffrn_measurement_device_type
;
D8 ADVANCE Bruker
;
_diffrn_radiation_monochromator  none
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type
;
 Cu K\a~1~~2~
;
_exptl_absorpt_coefficient_mu    40.450
_exptl_crystal_density_diffrn    4.480584
_pd_char_colour
;
colourless
;
_pd_meas_2theta_range_inc        0.0160352
_pd_meas_2theta_range_max        120.004454
_pd_meas_2theta_range_min        5
_pd_meas_scan_method             step
_pd_proc_ls_pref_orient_corr
;
Anisotropic model of PO. Spherical harmonics 4 ordrer.
 Jarvinen (1993). Application of symmetrized harmonics expansion to correction
of the preferred orientation effect. - J. Appl. Cryst. 26 p525-531.
;
_pd_proc_ls_profile_function     PearsonVII
_pd_proc_ls_prof_R_factor        2.668
_pd_proc_ls_prof_wR_expected     2.136
_pd_proc_ls_prof_wR_factor       3.589
_pd_proc_number_of_points        7172
_pd_spec_mount_mode              reflection
_refine_ls_goodness_of_fit_all   1.680
_refine_ls_R_I_factor            1.85
_refine_ls_shift/su_max          0.01000
_cod_data_source_file            Na0p5Li0p5FeGe2O6_300K.cif
_cod_data_source_block           a
_cod_original_sg_symbol_Hall
;
-C 2yc
;
_cod_original_sg_symbol_H-M      C2/c
_cod_original_formula_sum
;
Fe2 Ge4 Li Na O12
;
_cod_database_code               1529319
_cod_database_fobs_code          1529319
Crystal and magnetic structures, phase transitions in quasi-one-dimensional pyroxenes Na0.5Li0.5FeGe2O6
T.V. Drokina; G.A. Petrakovskii; M.S. Molokeev; S.V. Misyul; V.S. Bondarev; D.A. Velikanov; M. Frontzek; J. Schefer; Journal of Magnetism and Magnetic Materials 385 (2015) 243–249; doi:10.1016/j.jmmm.2015.03.016

data_1529320
_publ_section_title
;
 Crystal and magnetic structures, phase transitions in
 quasi-one-dimensional pyroxenes Na0.5Li0.5FeGe2O6
;
_journal_issue                   0
_journal_name_full               'Journal of Magnetism and Magnetic Materials'
_journal_page_first              243
_journal_page_last               249
_journal_paper_doi               10.1016/j.jmmm.2015.03.016
_journal_volume                  385
_journal_year                    2015
_chemical_formula_moiety         'Fe2 Ge4 Li Na O12'
_chemical_formula_sum            'Fe2 Ge4 Li Na O12'
_chemical_formula_weight         624.07
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_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                 108.4944(11)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.96920(30)
_cell_length_b                   8.85448(26)
_cell_length_c                   5.47516(18)
_cell_measurement_temperature    133
_cell_volume                     458.34(2)
_diffrn_ambient_temperature      133
_diffrn_measurement_device_type
;
D8 ADVANCE Bruker
;
_diffrn_radiation_monochromator  none
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type
;
 Cu K\a~1~~2~
;
_exptl_absorpt_coefficient_mu    40.822
_exptl_crystal_density_diffrn    4.522
_pd_char_colour
;
colourless
;
_pd_meas_2theta_range_inc        0.0160352
_pd_meas_2theta_range_max        120.004454
_pd_meas_2theta_range_min        5
_pd_meas_scan_method             step
_pd_proc_ls_pref_orient_corr
;
Anisotropic model of PO. Spherical harmonics 4 ordrer.
 Jarvinen (1993). Application of symmetrized harmonics expansion to correction
of the preferred orientation effect. - J. Appl. Cryst. 26 p525-531.
;
_pd_proc_ls_profile_function     PearsonVII
_pd_proc_ls_prof_R_factor        2.840
_pd_proc_ls_prof_wR_expected     2.339
_pd_proc_ls_prof_wR_factor       3.917
_pd_proc_number_of_points        7172
_pd_spec_mount_mode              reflection
_refine_ls_goodness_of_fit_all   1.675
_refine_ls_R_I_factor            1.53
_refine_ls_shift/su_max          0.01000
_cod_data_source_file            Na0p5Li0p5FeGe2O6_133K.cif
_cod_data_source_block           a
_cod_original_cell_volume        458.343(25)
_cod_original_sg_symbol_Hall
;
-P 2ybc
;
_cod_original_sg_symbol_H-M      P21/c
_cod_original_formula_sum
;
Fe2 Ge4 Li Na O12
;
_cod_database_code               1529320
_cod_database_fobs_code          1529320
The lanthanoid polyantimonides with the ideal compositions Pr5 Sb12 and Nd5 Sb12 crystallizing with a new structure type and Ho2 Sb5 with (Dy2 Sb5)-type structure
Schmidt, T.; Jeitschko, W.; Altmeyer, R.O.; Journal of Solid State Chemistry 173 (2003) 259–272; doi:

data_1534630
_publ_section_title
;
 The lanthanoid polyantimonides with the ideal compositions Pr5 Sb12 and
 Nd5 Sb12 crystallizing with a new structure type and Ho2 Sb5 with (Dy2
 Sb5)-type structure
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              259
_journal_page_last               272
_journal_volume                  173
_journal_year                    2003
_chemical_formula_sum            'Ho2 Sb5'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 102.14
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.018
_cell_length_b                   4.149
_cell_length_c                   14.511
_cell_volume                     766.236
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Schmidt_JSSCBI_2003_762.cif
_cod_data_source_block           Ho2Sb5
_cod_database_code               1534630