LMucko/crystallography-open-database huggingface dataset:
Crystal structure of potassium arsenidoniccolate
Somer, M.; Hartweg, M.; Peters, K.; von Schnering, H.G.; Zeitschrift fuer Kristallographie (149,1979-) 195 (1991) 99–100; doi:

data_8104516
_publ_section_title
;
 Crystal structure of potassium arsenidoniccolate
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              99
_journal_page_last               100
_journal_volume                  195
_journal_year                    1991
_chemical_formula_sum            'As7 K2 Ni12'
_chemical_name_systematic        'K2 Ni12 As7'
_space_group_IT_number           174
_symmetry_space_group_name_Hall  'P -6'
_symmetry_space_group_name_H-M   'P -6'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   9.429
_cell_length_b                   9.429
_cell_length_c                   3.7433
_cell_volume                     288.215
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Somer_ZEKRDZ_1991_1428.cif
_cod_data_source_block           As7K2Ni12
_cod_database_code               8104516
Crystal structure of dicesium pentachlorothallate
Thiele, G.; Richter, R.; Zeitschrift fuer Kristallographie (149,1979-) 205 (1993) 131–132; doi:

data_8104517
_publ_section_title
;
 Crystal structure of dicesium pentachlorothallate
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              131
_journal_page_last               132
_journal_volume                  205
_journal_year                    1993
_chemical_formula_sum            'Cl5 Cs2 Tl'
_chemical_name_systematic        'Cs2 (Tl Cl5)'
_space_group_IT_number           62
_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_formula_units_Z            4
_cell_length_a                   9.337
_cell_length_b                   7.493
_cell_length_c                   14.861
_cell_volume                     1039.707
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Thiele_ZEKRDZ_1993_1510.cif
_cod_data_source_block           Cl5Cs2Tl1
_cod_original_formula_sum        'Cl5 Cs2 Tl1'
_cod_database_code               8104517
Phase equilibria in the system (Li F) (Y F3)
Thoma, R.E.; Weaver, C.F.; Harris, L.A.; Friedman, H.A.; Insley, H.; Yakel, H.L.jr.; Journal of Physical Chemistry 65 (1961) 1096–1099; doi:

data_1542247
_publ_section_title
;
 Phase equilibria in the system (Li F) (Y F3)
;
_journal_name_full               'Journal of Physical Chemistry'
_journal_page_first              1096
_journal_page_last               1099
_journal_volume                  65
_journal_year                    1961
_chemical_formula_sum            'F4 Li Y'
_chemical_name_systematic        'Li Y F4'
_space_group_IT_number           88
_symmetry_space_group_name_Hall  'I 4bw -1bw'
_symmetry_space_group_name_H-M   'I 41/a :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.26
_cell_length_b                   5.26
_cell_length_c                   10.94
_cell_volume                     302.684
_citation_journal_id_ASTM        JPCHAX
_cod_data_source_file            Thoma_JPCHAX_1961_125.cif
_cod_data_source_block           F4Li1Y1
_cod_original_cell_volume        302.6836
_cod_original_sg_symbol_Hall     '-I 4ad (x,y+1/4,z+1/8)'
_cod_original_formula_sum        'F4 Li1 Y1'
_cod_database_code               1542247
Crystal structure of zinc indium selenide, Zn In2 Se4
Trah, H.P.; Kraemer, V.; Zeitschrift fuer Kristallographie (149,1979-) 173 (1985) 199–203; doi:

data_8104518
_publ_section_title
;
 Crystal structure of zinc indium selenide, Zn In2 Se4
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              199
_journal_page_last               203
_journal_volume                  173
_journal_year                    1985
_chemical_formula_sum            'In2 Se4 Zn'
_chemical_name_systematic        'Zn In2 Se4'
_space_group_IT_number           121
_symmetry_space_group_name_Hall  'I -4 2'
_symmetry_space_group_name_H-M   'I -4 2 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.7095
_cell_length_b                   5.7095
_cell_length_c                   11.449
_cell_volume                     373.219
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Trah_ZEKRDZ_1985_1357.cif
_cod_data_source_block           In2Se4Zn1
_cod_original_formula_sum        'In2 Se4 Zn1'
_cod_database_code               8104518
Anomalous variations in the lattice constants and the dielectric and piezoelectric parameters of (Ba, Pb) Ti O3 solid solutions
Venevtsev, Yu.N.; Zhdanov, G.S.; Bondarenko, V.S.; Chkalova, V.V.; Stember, N.G.; Kristallografiya 6 (1961) 375–380; doi:

data_1542248
_publ_section_title
;
 Anomalous variations in the lattice constants and the dielectric and
 piezoelectric parameters of (Ba, Pb) Ti O3 solid solutions
;
_journal_name_full               Kristallografiya
_journal_page_first              375
_journal_page_last               380
_journal_volume                  6
_journal_year                    1961
_chemical_formula_sum            'Ba0.8 O3 Pb0.2 Ti'
_chemical_name_systematic        '(Ba0.8 Pb0.2) (Ti O3)'
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.977
_cell_length_b                   3.977
_cell_length_c                   4.042
_cell_volume                     63.930
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Venevtsev_KRISAJ_1961_842.cif
_cod_data_source_block           Ba0.8O3Pb0.2Ti1
_cod_original_cell_volume        63.93041
_cod_original_formula_sum        'Ba0.8 O3 Pb0.2 Ti1'
_cod_database_code               1542248
Study of Carbonate Compounds of Pentavalent Actinides with Alkali Metal Cations. VI. X-ray Structure Investigation of the Compounds Li Np O2 C O3 and Na Np O2 C O3
Volkov, Yu.F.; Tomilin, S.V.; Visyashcheva, G.I.; Kapshukov, I.I.; Radiokhimiya 21 (1979) 668–672; doi:

data_1542249
_publ_section_title
;
 Study of Carbonate Compounds of Pentavalent Actinides with Alkali Metal
 Cations. VI. X-ray Structure Investigation of the Compounds Li Np O2 C O3
 and Na Np O2 C O3
;
_journal_name_full               Radiokhimiya
_journal_page_first              668
_journal_page_last               672
_journal_volume                  21
_journal_year                    1979
_chemical_formula_sum            'C Na Np O5'
_chemical_name_systematic        'Na Np O2 (C O3)'
_space_group_IT_number           31
_symmetry_space_group_name_Hall  'P -2ab -2'
_symmetry_space_group_name_H-M   'P m 21 n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.856
_cell_length_b                   10.68
_cell_length_c                   4.368
_cell_volume                     226.534
_citation_journal_id_ASTM        RADKAU
_cod_data_source_file            Volkov_RADKAU_1979_1284.cif
_cod_data_source_block           C1Na1Np1O5
_cod_original_cell_volume        226.5336
_cod_original_sg_symbol_Hall     'P 2ac -2 (-x,z,y)'
_cod_original_formula_sum        'C1 Na1 Np1 O5'
_cod_database_code               1542249
K2 V O F4
Waltersson, K.; Karlsson, B.; Crystal Structure Communications 7 (1978) 459–462; doi:

data_1542250
_publ_section_title
;
 K2 V O F4
;
_journal_name_full               'Crystal Structure Communications'
_journal_page_first              459
_journal_page_last               462
_journal_volume                  7
_journal_year                    1978
_chemical_formula_sum            'F4 K2 O V'
_chemical_name_systematic        'K2 V O F4'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P -2ac -2n'
_symmetry_space_group_name_H-M   'P n 21 a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.403
_cell_length_b                   5.65
_cell_length_c                   11.443
_cell_volume                     478.626
_citation_journal_id_ASTM        CSCMCS
_cod_data_source_file            Waltersson_CSCMCS_1978_1369.cif
_cod_data_source_block           F4K2O1V1
_cod_original_cell_volume        478.6258
_cod_original_sg_symbol_Hall     'P 2c -2n (-x,z,y)'
_cod_original_formula_sum        'F4 K2 O1 V1'
_cod_database_code               1542250
Ueber Quecksilberoxyhalogenide. II. Die Kristallstruktur des Trichloro-triquecksilber(II)-oxoniumchlorids
Weiss, A.; Nagorsen, G.; Zeitschrift fuer Anorganische und Allgemeine Chemie 274 (1953) 151–168; doi:

data_1542251
_publ_section_title
;
 Ueber Quecksilberoxyhalogenide. II. Die Kristallstruktur des
 Trichloro-triquecksilber(II)-oxoniumchlorids
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              151
_journal_page_last               168
_journal_volume                  274
_journal_year                    1953
_chemical_formula_sum            'Cl4 Hg3 O'
_chemical_name_systematic        'Hg3 O Cl4'
_space_group_IT_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                   9.26
_cell_length_b                   9.26
_cell_length_c                   9.26
_cell_volume                     794.023
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Weiss_ZAACAB_1953_943.cif
_cod_data_source_block           Cl4Hg3O1
_cod_original_cell_volume        794.0228
_cod_original_formula_sum        'Cl4 Hg3 O1'
_cod_database_code               1542251
Zur Chemie des Quecksilbers XII. Zur Kenntnis von basischem Quecksilberchlorat und basischem Quecksilberbromat
Weiss, A.; Lyng, S.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977) 15 (1960) 678–678; doi:

data_7223832
_publ_section_title
;
 Zur Chemie des Quecksilbers XII. Zur Kenntnis von basischem
 Quecksilberchlorat und basischem Quecksilberbromat
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (2,1947-32,1977)
;
_journal_page_first              678
_journal_page_last               678
_journal_volume                  15
_journal_year                    1960
_chemical_formula_sum            'Cl H Hg O4'
_chemical_name_systematic        'Hg (Cl O3) (O H)'
_space_group_IT_number           57
_symmetry_space_group_name_Hall  '-P 2c 2b'
_symmetry_space_group_name_H-M   'P b c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.62
_cell_length_b                   11.43
_cell_length_c                   7.15
_cell_volume                     377.567
_citation_journal_id_ASTM        ZENBAX
_cod_data_source_file            Weiss_ZENBAX_1960_1106.cif
_cod_data_source_block           H1Cl1Hg1O4
_cod_original_cell_volume        377.5672
_cod_original_formula_sum        'H1 Cl1 Hg1 O4'
_cod_database_code               7223832
Zur Chemie des Quecksilbers XII. Zur Kenntnis von basischem Quecksilberchlorat und basischem Quecksilberbromat
Weiss, A.; Lyng, S.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977) 15 (1960) 678–678; doi:

data_7223833
_publ_section_title
;
 Zur Chemie des Quecksilbers XII. Zur Kenntnis von basischem
 Quecksilberchlorat und basischem Quecksilberbromat
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (2,1947-32,1977)
;
_journal_page_first              678
_journal_page_last               678
_journal_volume                  15
_journal_year                    1960
_chemical_formula_sum            'Br H Hg O4'
_chemical_name_systematic        'Hg Br O3 O H'
_space_group_IT_number           57
_symmetry_space_group_name_Hall  '-P 2c 2b'
_symmetry_space_group_name_H-M   'P b c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.61
_cell_length_b                   11.59
_cell_length_c                   7.24
_cell_volume                     386.832
_citation_journal_id_ASTM        ZENBAX
_cod_data_source_file            Weiss_ZENBAX_1960_1107.cif
_cod_data_source_block           H1Br1Hg1O4
_cod_original_cell_volume        386.8325
_cod_original_formula_sum        'H1 Br1 Hg1 O4'
_cod_database_code               7223833
The crystal structure of Cs Cr3 O8
Wilhelmi, K.A.; Arkiv foer Kemi 26 (1967) 141–147; doi:

data_1542252
_publ_section_title
;
 The crystal structure of Cs Cr3 O8
;
_journal_name_full               'Arkiv foer Kemi'
_journal_page_first              141
_journal_page_last               147
_journal_volume                  26
_journal_year                    1967
_chemical_formula_sum            'Cr3 Cs O8'
_chemical_name_systematic        'Cs Cr3 O8'
_space_group_IT_number           62
_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_formula_units_Z            4
_cell_length_a                   15.957
_cell_length_b                   5.505
_cell_length_c                   8.264
_cell_volume                     725.937
_citation_journal_id_ASTM        ARKEAD
_cod_data_source_file            Wilhelmi_ARKEAD_1967_695.cif
_cod_data_source_block           Cr3Cs1O8
_cod_original_cell_volume        725.9369
_cod_original_formula_sum        'Cr3 Cs1 O8'
_cod_database_code               1542252
Crystal Structure of Magnesium Ditelluride
Yanagisawa, S.; Tashiro, M.; Anzai, S.; Journal of Inorganic and Nuclear Chemistry 31 (1969) 943–946; doi:

data_4031808
_publ_section_title
;
 Crystal Structure of Magnesium Ditelluride
;
_journal_name_full               'Journal of Inorganic and Nuclear Chemistry'
_journal_page_first              943
_journal_page_last               946
_journal_volume                  31
_journal_year                    1969
_chemical_formula_sum            'Mg Te2'
_space_group_IT_number           205
_symmetry_space_group_name_Hall  '-P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P a -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.025
_cell_length_b                   7.025
_cell_length_c                   7.025
_cell_volume                     346.688
_citation_journal_id_ASTM        JINCAO
_cod_data_source_file            Yanagisawa_JINCAO_1969_1701.cif
_cod_data_source_block           Mg1Te2
_cod_original_cell_volume        346.6881
_cod_original_formula_sum        'Mg1 Te2'
_cod_database_code               4031808
Application of the Pattern-Fitting Structure-Refinement Method to X-ray Powder Diffractometer Patterns
Young, R.A.; Mackie, P.E.; von Dreele, R.B.; Journal of Applied Crystallography 10 (1977) 262–269; doi:

data_2300587
_publ_section_title
;
 Application of the Pattern-Fitting Structure-Refinement Method to X-ray
 Powder Diffractometer Patterns
;
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              262
_journal_page_last               269
_journal_volume                  10
_journal_year                    1977
_chemical_formula_sum            'Ca9.2 O22.2'
_chemical_name_systematic        'Ca9.2 (P O4)5.55 F2'
_space_group_IT_number           176
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   9.3653
_cell_length_b                   9.3653
_cell_length_c                   6.8816
_cell_volume                     522.713
_citation_journal_id_ASTM        JACGAR
_cod_data_source_file            Young_JACGAR_1977_95.cif
_cod_data_source_block           Ca9.2O22.2
_cod_original_cell_volume        522.7132
_cod_database_code               2300587
Effect of tri- and tetravalent metal doping on the electrochemical properties of lanthanum tungstate proton conductors
Porras-Vázquez, José Manuel; dos Santos_Gómez, Lucía; Marrero-López, David; Slater, Peter; Masó, Nahum; Magrasó, Anna; Losilla, Enrique R. R.; Dalton Trans.  (2016) –; doi:10.1039/C5DT03833B

data_7037924
_publ_section_title
;
 Effect of tri- and tetravalent metal doping on the electrochemical
 properties of lanthanum tungstate proton conductors
;
_journal_name_full               'Dalton Trans.'
_journal_paper_doi               10.1039/C5DT03833B
_journal_year                    2016
_chemical_formula_sum            'La6.77 O13.72 W1.2 Zr0.03'
_chemical_formula_weight         1383.71
_chemical_name_systematic        ' ?'
_space_group_IT_number           225
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2015-12-15T10:37
_audit_creation_method           'from EXP file using GSAS2CIF'
_audit_update_record
' 2015-12-15T10:37  Initial CIF as created by GSAS2CIF'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   11.17662(6)
_cell_length_b                   11.17662
_cell_length_c                   11.17662
_cell_volume                     1396.148(7)
_computing_structure_refinement  GSAS
_pd_block_id
2015-12-15T10:37|ZR010_W_phase1|J.M.Porras-Vazquez||
_pd_phase_name
'from C:/Users/JoseManuel/Dropbox/Malaga_2014_2015_2016/NPD_wolfram'
_refine_ls_goodness_of_fit_all   2.77
_refine_ls_matrix_type           full
_refine_ls_number_parameters     85
_refine_ls_number_restraints     0
_refine_ls_shift/su_max          0.20
_refine_ls_shift/su_mean         0.00
_cod_data_source_file            c5dt03833b3.cif
_cod_data_source_block           ZR010_W_phase_1
_cod_original_cell_volume        1396.148(22)
_cod_original_formula_sum        'La6.77 O13.72 W1.20 Zr0.03'
_cod_database_code               7037924
Effect of tri- and tetravalent metal doping on the electrochemical properties of lanthanum tungstate proton conductors
Porras-Vázquez, José Manuel; dos Santos_Gómez, Lucía; Marrero-López, David; Slater, Peter; Masó, Nahum; Magrasó, Anna; Losilla, Enrique R. R.; Dalton Trans.  (2016) –; doi:10.1039/C5DT03833B

data_7037925
_publ_section_title
;
 Effect of tri- and tetravalent metal doping on the electrochemical
 properties of lanthanum tungstate proton conductors
;
_journal_name_full               'Dalton Trans.'
_journal_paper_doi               10.1039/C5DT03833B
_journal_year                    2016
_chemical_formula_sum            'La6.77 O13.78 W1.16 Zr0.07'
_chemical_formula_weight         1380.79
_chemical_name_systematic        ' ?'
_space_group_IT_number           225
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2015-12-15T10:29
_audit_creation_method           'from EXP file using GSAS2CIF'
_audit_update_record
' 2015-12-15T10:29  Initial CIF as created by GSAS2CIF'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   11.18319(5)
_cell_length_b                   11.18319
_cell_length_c                   11.18319
_cell_volume                     1398.612(6)
_computing_structure_refinement  GSAS
_pd_block_id
2015-12-15T10:29|ZR005_W_ANISO_phase1|J.M.Porras-Vazquez||
_pd_phase_name
'from C:/Users/JoseManuel/Dropbox/Malaga_2014_2015_2016/NPD_wolfram'
_refine_ls_goodness_of_fit_all   2.52
_refine_ls_matrix_type           full
_refine_ls_number_parameters     86
_refine_ls_number_restraints     0
_refine_ls_shift/su_max          1.35
_refine_ls_shift/su_mean         0.02
_cod_data_source_file            c5dt03833b5.cif
_cod_data_source_block           ZR005_W_ANISO_phase_1
_cod_original_cell_volume        1398.611(19)
_cod_database_code               7037925
Effect of tri- and tetravalent metal doping on the electrochemical properties of lanthanum tungstate proton conductors
Porras-Vázquez, José Manuel; dos Santos_Gómez, Lucía; Marrero-López, David; Slater, Peter; Masó, Nahum; Magrasó, Anna; Losilla, Enrique R. R.; Dalton Trans.  (2016) –; doi:10.1039/C5DT03833B

data_7037926
_publ_section_title
;
 Effect of tri- and tetravalent metal doping on the electrochemical
 properties of lanthanum tungstate proton conductors
;
_journal_name_full               'Dalton Trans.'
_journal_paper_doi               10.1039/C5DT03833B
_journal_year                    2016
_chemical_formula_sum            'La6.77 O13.78 Ti0.07 W1.16'
_chemical_formula_weight         1377.78
_chemical_name_systematic        ' ?'
_space_group_IT_number           225
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2015-12-15T10:03
_audit_creation_method           'from EXP file using GSAS2CIF'
_audit_update_record
' 2015-12-15T10:03  Initial CIF as created by GSAS2CIF'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   11.17723(6)
_cell_length_b                   11.17723
_cell_length_c                   11.17723
_cell_volume                     1396.377(7)
_computing_structure_refinement  GSAS
_pd_block_id
2015-12-15T10:03|TI005_W_ANISO_phase1|J.M.Porras-Vazquez||
_pd_phase_name
'from C:/Users/JoseManuel/Dropbox/Malaga_2014_2015_2016/NPD_wolfram'
_refine_ls_goodness_of_fit_all   2.77
_refine_ls_matrix_type           full
_refine_ls_number_parameters     88
_refine_ls_number_restraints     0
_refine_ls_shift/su_max          0.07
_refine_ls_shift/su_mean         0.00
_cod_data_source_file            c5dt03833b4.cif
_cod_data_source_block           TI005_W_ANISO_phase_1
_cod_original_cell_volume        1396.375(21)
_cod_database_code               7037926