LMucko/crystallography-open-database huggingface dataset:
Refinement of the Crystal Structure of Mercuric Sulfate Monohydrate
Templeton, L.K.; Zalkin, A.; Templeton, D.H.; Acta Crystallographica (1,1948-23,1967) 17 (1964) 933–936; doi:

data_2310684
_publ_section_title
;
 Refinement of the Crystal Structure of Mercuric Sulfate Monohydrate
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              933
_journal_page_last               936
_journal_volume                  17
_journal_year                    1964
_chemical_formula_sum            'H2 Hg O5 S'
_chemical_name_systematic        'Hg S O4 H2 O'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2n 2a'
_symmetry_space_group_name_H-M   'P m c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.416
_cell_length_b                   8.964
_cell_length_c                   7.874
_cell_volume                     382.275
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Templeton_ACCRA9_1964_159.cif
_cod_data_source_block           H2Hg1O5S1
_cod_original_sg_symbol_Hall     '-P 2ac 2n (y,z,x)'
_cod_original_formula_sum        'H2 Hg1 O5 S1'
_cod_database_code               2310684
Bie Kristallstruktur des Natriumhexafluoroantimonats(V)
Teufer, G.; Acta Crystallographica (1,1948-23,1967) 9 (1956) 539–540; doi:

data_2310685
_publ_section_title
;
 Bie Kristallstruktur des Natriumhexafluoroantimonats(V)
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              539
_journal_page_last               540
_journal_volume                  9
_journal_year                    1956
_chemical_formula_sum            'F6 Na Sb'
_chemical_name_systematic        'Na (Sb F6)'
_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            4
_cell_length_a                   8.184
_cell_length_b                   8.184
_cell_length_c                   8.184
_cell_volume                     548.147
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Teufer_ACCRA9_1956_197.cif
_cod_data_source_block           F6Na1Sb1
_cod_original_cell_volume        548.1468
_cod_original_formula_sum        'F6 Na1 Sb1'
_cod_database_code               2310685
Bie Kristallstruktur des wasserhaltigen Natriumhexafluorophosphats, Na P F6 H2 O
Teufer, G.; Bode, H.; Acta Crystallographica (1,1948-23,1967) 9 (1956) 825–827; doi:

data_2310686
_publ_section_title
;
 Bie Kristallstruktur des wasserhaltigen Natriumhexafluorophosphats, Na P
 F6 H2 O
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              825
_journal_page_last               827
_journal_volume                  9
_journal_year                    1956
_chemical_formula_sum            'F6 H2 Na O P'
_chemical_name_systematic        'Na (P F6) (H2 O)'
_space_group_IT_number           74
_symmetry_space_group_name_Hall  '-I 2b 2'
_symmetry_space_group_name_H-M   'I m m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.962
_cell_length_b                   10.594
_cell_length_c                   6.116
_cell_volume                     515.881
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Teufer_ACCRA9_1956_208.cif
_cod_data_source_block           H2F6Na1O1P1
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2017-08-09
;
_cod_original_cell_volume        515.8811
_cod_original_formula_sum        'H2 F6 Na1 O1 P1'
_cod_database_code               2310686
Ueber die Iodoplatinate M2 Pt I5 (M = K, Rb, N H4)
Thiele, G.; Mrozek, C.; Wittmann, K.; Wirkner, H.; Naturwissenschaften 65 (1978) 206–207; doi:

data_1528917
_publ_section_title
;
 Ueber die Iodoplatinate M2 Pt I5 (M = K, Rb, N H4)
;
_journal_name_full               Naturwissenschaften
_journal_page_first              206
_journal_page_last               207
_journal_volume                  65
_journal_year                    1978
_chemical_formula_sum            'I5 K2 Pt'
_chemical_name_systematic        'K2 Pt I5'
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.305
_cell_length_b                   8.884
_cell_length_c                   11.813
_cell_volume                     1396.316
_citation_journal_id_ASTM        NATWAY
_cod_data_source_file            Thiele_NATWAY_1978_126.cif
_cod_data_source_block           I5K2Pt1
_cod_original_formula_sum        'I5 K2 Pt1'
_cod_database_code               1528917
Ueber die Iodoplatinate M2 Pt I5 (M = K, Rb, N H4)
Thiele, G.; Mrozek, C.; Wittmann, K.; Wirkner, H.; Naturwissenschaften 65 (1978) 206–207; doi:

data_1528918
_publ_section_title
;
 Ueber die Iodoplatinate M2 Pt I5 (M = K, Rb, N H4)
;
_journal_name_full               Naturwissenschaften
_journal_page_first              206
_journal_page_last               207
_journal_volume                  65
_journal_year                    1978
_chemical_formula_sum            'I5 Pt Rb2'
_chemical_name_systematic        'Rb2 Pt I5'
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.386
_cell_length_b                   8.985
_cell_length_c                   11.882
_cell_volume                     1429.086
_citation_journal_id_ASTM        NATWAY
_cod_data_source_file            Thiele_NATWAY_1978_129.cif
_cod_data_source_block           I5Pt1Rb2
_cod_original_formula_sum        'I5 Pt1 Rb2'
_cod_database_code               1528918
Structure de l'Antimoniate de Baryum Ba Sb3 O5 (O H)
Thillier-Chevin, F.; Maraine, P.; Perez, G.; Acta Crystallographica B (24,1968-38,1982) 37 (1981) 11–15; doi:

data_2106605
_publ_section_title
;
 Structure de l'Antimoniate de Baryum Ba Sb3 O5 (O H)
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              11
_journal_page_last               15
_journal_volume                  37
_journal_year                    1981
_chemical_formula_sum            'Ba H O6 Sb3'
_chemical_name_systematic        'Ba Sb3 O5 (O H)'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.69
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.974
_cell_length_b                   5.714
_cell_length_c                   14.195
_cell_volume                     715.251
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Thillier-Chevin_ACBCAR_1981_21.cif
_cod_data_source_block           H1Ba1O6Sb3
_cod_original_cell_volume        715.2509
_cod_original_formula_sum        'H1 Ba1 O6 Sb3'
_cod_database_code               2106605
Synthesis, structure, and magneto-transport of Ln Ni(1-x) Sb2 (Ln = Y, Gd - Er)
Thomas, E.L.; Chan, J.Y.; Young, D.P.; Moldovan, M.; Chemistry of Materials (1,1989-) 17 (2005) 5810–5816; doi:

data_4002429
_publ_section_title
;
 Synthesis, structure, and magneto-transport of Ln Ni(1-x) Sb2 (Ln = Y, Gd
 - Er)
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              5810
_journal_page_last               5816
_journal_volume                  17
_journal_year                    2005
_chemical_formula_sum            'Ni0.57 Sb2 Y'
_chemical_name_systematic        'Y Ni0.57 Sb2'
_space_group_IT_number           129
_symmetry_space_group_name_Hall  '-P 4a 2a'
_symmetry_space_group_name_H-M   'P 4/n m m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.289
_cell_length_b                   4.289
_cell_length_c                   9.299
_cell_volume                     171.060
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Thomas_CMATEX_2005_1060.cif
_cod_data_source_block           Ni0.57Sb2Y1
_cod_original_cell_volume        171.06
_cod_original_formula_sum        'Ni0.57 Sb2 Y1'
_cod_database_code               4002429
Crystal growth, transport, and magnetic properties of Ln3 Co4 Sn13 (Ln = La, Ce) with a perovskite-like structure
Thomas, E.L.; Lee Han-Oh; Bankston, A.N.; MaQuilon, S.; Moldovan, M.; Klavins, P.; Young, D.P.; Fisk, Z.; Chan, J.Y.; Journal of Solid State Chemistry 179 (2006) 1642–1649; doi:

data_1528919
_publ_section_title
;
 Crystal growth, transport, and magnetic properties of Ln3 Co4 Sn13 (Ln =
 La, Ce) with a perovskite-like structure
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1642
_journal_page_last               1649
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Ce3 Co4 Sn13'
_space_group_IT_number           223
_symmetry_space_group_name_Hall  '-P 4n 2 3'
_symmetry_space_group_name_H-M   'P m -3 n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.602
_cell_length_b                   9.602
_cell_length_c                   9.602
_cell_volume                     885.289
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Thomas_JSSCBI_2006_1151.cif
_cod_data_source_block           Ce3Co4Sn13
_cod_original_cell_volume        885.2891
_cod_database_code               1528919
Crystal growth, transport, and magnetic properties of Ln3 Co4 Sn13 (Ln = La, Ce) with a perovskite-like structure
Thomas, E.L.; Bankston, A.N.; Lee Han-Oh; Klavins, P.; MaQuilon, S.; Moldovan, M.; Fisk, Z.; Young, D.P.; Chan, J.Y.; Journal of Solid State Chemistry 179 (2006) 1642–1649; doi:

data_1528920
_publ_section_title
;
 Crystal growth, transport, and magnetic properties of Ln3 Co4 Sn13 (Ln =
 La, Ce) with a perovskite-like structure
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1642
_journal_page_last               1649
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Co4 La3 Sn13'
_chemical_name_systematic        'La3 Co4 Sn13'
_space_group_IT_number           223
_symmetry_space_group_name_Hall  '-P 4n 2 3'
_symmetry_space_group_name_H-M   'P m -3 n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.643
_cell_length_b                   9.643
_cell_length_c                   9.643
_cell_volume                     896.678
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Thomas_JSSCBI_2006_1153.cif
_cod_data_source_block           Co4La3Sn13
_cod_original_cell_volume        896.6779
_cod_database_code               1528920
Novel series of ribbon structures in dialkylammonium chlorocadmates obtained by dimensional reduction of the hexagonal Cd Cl2 lattice
Thorn, A.; Twamley, B.; Willett, R.D.; Crystal Growth and Design 6 (2006) 1134–1142; doi:

data_4513416
_publ_section_title
;
 Novel series of ribbon structures in dialkylammonium chlorocadmates
 obtained by dimensional reduction of the hexagonal Cd Cl2 lattice
;
_journal_name_full               'Crystal Growth and Design'
_journal_page_first              1134
_journal_page_last               1142
_journal_volume                  6
_journal_year                    2006
_chemical_formula_sum            'C2 H12 Cd2 Cl5 N O2'
_chemical_name_systematic        '((C H3)2 N H2) (Cd2 Cl5 (H2 O)) (H2 O)'
_space_group_IT_number           9
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 125.44
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.089
_cell_length_b                   21.674
_cell_length_c                   6.521
_cell_volume                     1276.897
_citation_journal_id_ASTM        CGDEFU
_cod_data_source_file            Thorn_CGDEFU_2006_938.cif
_cod_data_source_block           C2H12Cd2Cl5N1O2
_cod_original_cell_volume        1276.896
_cod_original_formula_sum        'C2 H12 Cd2 Cl5 N1 O2'
_cod_database_code               4513416
Anomalous lattice parameter increase in alkali earth aluminium substituted tungsten defect pyrochlores
Thorogood, G.J.; Peterson, V.K.; Kennedy, B.J.; Kearley, G.J.; Elcombe, M.M.; Hanna, J.V.; Luca, V.; Journal of Solid State Chemistry 182 (2009) 457–464; doi:

data_1528921
_publ_section_title
;
 Anomalous lattice parameter increase in alkali earth aluminium
 substituted tungsten defect pyrochlores
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              457
_journal_page_last               464
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'Al0.33 K O6 W1.67'
_chemical_name_systematic        'K Al0.33 W1.67 O6'
_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                   10.1808
_cell_length_b                   10.1808
_cell_length_c                   10.1808
_cell_volume                     1055.227
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Thorogood_JSSCBI_2009_1694.cif
_cod_data_source_block           Al0.33K1O6W1.67
_cod_original_formula_sum        'Al0.33 K1 O6 W1.67'
_cod_database_code               1528921
Anomalous lattice parameter increase in alkali earth aluminium substituted tungsten defect pyrochlores
Thorogood, G.J.; Hanna, J.V.; Peterson, V.K.; Kennedy, B.J.; Kearley, G.J.; Elcombe, M.M.; Luca, V.; Journal of Solid State Chemistry 182 (2009) 457–464; doi:

data_1528922
_publ_section_title
;
 Anomalous lattice parameter increase in alkali earth aluminium
 substituted tungsten defect pyrochlores
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              457
_journal_page_last               464
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'Al0.33 O6 Rb W1.67'
_chemical_name_systematic        'Rb Al0.33 W1.67 O6'
_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                   10.1726
_cell_length_b                   10.1726
_cell_length_c                   10.1726
_cell_volume                     1052.679
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Thorogood_JSSCBI_2009_1695.cif
_cod_data_source_block           Al0.33O6Rb1W1.67
_cod_original_formula_sum        'Al0.33 O6 Rb1 W1.67'
_cod_database_code               1528922
Anomalous lattice parameter increase in alkali earth aluminium substituted tungsten defect pyrochlores
Thorogood, G.J.; Luca, V.; Peterson, V.K.; Kennedy, B.J.; Kearley, G.J.; Elcombe, M.M.; Hanna, J.V.; Journal of Solid State Chemistry 182 (2009) 457–464; doi:

data_1528923
_publ_section_title
;
 Anomalous lattice parameter increase in alkali earth aluminium
 substituted tungsten defect pyrochlores
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              457
_journal_page_last               464
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'Al0.33 Cs O6 W1.67'
_chemical_name_systematic        'Cs Al0.33 W1.67 O6'
_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                   10.207
_cell_length_b                   10.207
_cell_length_c                   10.207
_cell_volume                     1063.394
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Thorogood_JSSCBI_2009_1696.cif
_cod_data_source_block           Al0.33Cs1O6W1.67
_cod_original_formula_sum        'Al0.33 Cs1 O6 W1.67'
_cod_database_code               1528923
Ueber Sauerstoffperowskite mit fuenf- und vierwertigem Iridium. Verbindungen vom Typ Ba2 B(3+) Ir(5+) O6 und Ba3 B(3+) Ir2(4,5+) O9
Thumm, I.; Kemmler-Sack, S.; Treiber, U.; Journal of Solid State Chemistry 35 (1980) 156–166; doi:

data_1528924
_publ_section_title
;
 Ueber Sauerstoffperowskite mit fuenf- und vierwertigem Iridium.
 Verbindungen vom Typ Ba2 B(3+) Ir(5+) O6 und Ba3 B(3+) Ir2(4,5+) O9
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              156
_journal_page_last               166
_journal_volume                  35
_journal_year                    1980
_chemical_formula_sum            'Ba3 Ir2 O9 Y'
_chemical_name_systematic        'Ba3 Y Ir2 O9'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   5.885
_cell_length_b                   5.885
_cell_length_c                   14.627
_cell_volume                     438.711
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Thumm_JSSCBI_1980_14.cif
_cod_data_source_block           Ba3Ir2O9Y1
_cod_original_cell_volume        438.7113
_cod_original_formula_sum        'Ba3 Ir2 O9 Y1'
_cod_database_code               1528924
Ueber Sauerstoffperowskite mit fuenf- und vierwertigem Iridium. Verbindungen vom Typ Ba2 B(3+) Ir(5+) O6 und Ba3 B(3+) Ir2(4,5+) O9
Thumm, I.; Treiber, U.; Kemmler-Sack, S.; Journal of Solid State Chemistry 35 (1980) 156–166; doi:

data_1528925
_publ_section_title
;
 Ueber Sauerstoffperowskite mit fuenf- und vierwertigem Iridium.
 Verbindungen vom Typ Ba2 B(3+) Ir(5+) O6 und Ba3 B(3+) Ir2(4,5+) O9
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              156
_journal_page_last               166
_journal_volume                  35
_journal_year                    1980
_chemical_formula_sum            'Ba3 Ir2 O9 Sm'
_chemical_name_systematic        'Ba3 Sm Ir2 O9'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   5.925
_cell_length_b                   5.925
_cell_length_c                   14.785
_cell_volume                     449.499
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Thumm_JSSCBI_1980_15.cif
_cod_data_source_block           Ba3Ir2O9Sm1
_cod_original_formula_sum        'Ba3 Ir2 O9 Sm1'
_cod_database_code               1528925
Neutron diffraction study of diammonium trihydrogen periodate, (N H4)2 H3 I O6, and its deuterium analogue, (N D4)2 D3 I O6
Tichy, K.; Rueegg, A.; Benes, J.; Acta Crystallographica B (24,1968-38,1982) 36 (1980) 1028–1032; doi:

data_2106606
_publ_section_title
;
 Neutron diffraction study of diammonium trihydrogen periodate, (N H4)2 H3
 I O6, and its deuterium analogue, (N D4)2 D3 I O6
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1028
_journal_page_last               1032
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'H11 I N2 O6'
_chemical_name_systematic        '(N H4)2 (H3 I O6)'
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   6.9233
_cell_length_b                   6.9233
_cell_length_c                   11.1491
_cell_volume                     462.804
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Tichy_ACBCAR_1980_71.cif
_cod_data_source_block           H11I1N2O6
_cod_original_cell_volume        462.8036
_cod_original_formula_sum        'H11 I1 N2 O6'
_cod_database_code               2106606
Zur Kristallstruktur eines sekundaeren Ca, Cu, Sb-Arsenats aus dem Richelsdorfer Gebirge
Tillmann, B.; Suesse, P.; Fortschritte der Mineralogie, Beiheft 60 (1982) 200–201; doi:

data_1528926
_publ_section_title
;
 Zur Kristallstruktur eines sekundaeren Ca, Cu, Sb-Arsenats aus dem
 Richelsdorfer Gebirge
;
_journal_name_full               'Fortschritte der Mineralogie, Beiheft'
_journal_page_first              200
_journal_page_last               201
_journal_volume                  60
_journal_year                    1982
_chemical_formula_sum            'As4 Ca2 Cl Cu5 H18 O28 Sb'
_chemical_name_systematic        'Cu5 Ca2 Sb Cl (O H)6 (As O4)4 (H2 O)6'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 101
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   14.13
_cell_length_b                   14.21
_cell_length_c                   13.59
_cell_volume                     2678.566
_citation_journal_id_ASTM        FMNBB6
_cod_data_source_file            Tillmann_FMNBB6_1982_598.cif
_cod_data_source_block           H18As4Ca2Cl1Cu5O28Sb1
_cod_original_formula_sum        'H18 As4 Ca2 Cl1 Cu5 O28 Sb1'
_cod_database_code               1528926
A structure and phase analysis investigation of the 1:1 ordered A2 In Nb O6 perovskites (A = Ca(2+), Sr(2+), Ba(2+))
Ting, V.; Liu, Y.; James, M.; Noren, L.; Withers, R.L.; Fitz Gerald, J.D.; Journal of Solid State Chemistry 179 (2006) 551–562; doi:

data_1528927
_publ_section_title
;
 A structure and phase analysis investigation of the 1:1 ordered A2 In Nb
 O6 perovskites (A = Ca(2+), Sr(2+), Ba(2+))
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              551
_journal_page_last               562
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Ba2 In Nb O6'
_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            4
_cell_length_a                   8.2819
_cell_length_b                   8.2819
_cell_length_c                   8.2819
_cell_volume                     568.054
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Ting_JSSCBI_2006_927.cif
_cod_data_source_block           Ba2In1Nb1O6
_cod_original_cell_volume        568.0545
_cod_original_formula_sum        'Ba2 In1 Nb1 O6'
_cod_database_code               1528927