LMucko/crystallography-open-database huggingface dataset:
High temperature crystallographic study of (La0.9 Sr0.1) M(III) O3-d (M(III) = Sc, In and Lu) perovskite proton conductor
Nomura, K.; Takeuchi, T.; Kageyama, H.; Miyazaki, Y.; Solid State Ionics 162 (2003) 99–104; doi:

data_1532757
_publ_section_title
;
 High temperature crystallographic study of (La0.9 Sr0.1) M(III) O3-d
 (M(III) = Sc, In and Lu) perovskite proton conductor
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              99
_journal_page_last               104
_journal_volume                  162
_journal_year                    2003
_chemical_formula_sum            'La0.9 O2.95 Sc Sr0.1'
_chemical_name_systematic        '(La0.9 Sr0.1) Sc O2.95'
_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                   5.8043
_cell_length_b                   8.1524
_cell_length_c                   5.725
_cell_volume                     270.901
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Nomura_SSIOD3_2003_925.cif
_cod_data_source_block           La0.9O2.95Sc1Sr0.1
_cod_original_cell_volume        270.9011
_cod_original_formula_sum        'La0.9 O2.95 Sc1 Sr0.1'
_cod_database_code               1532757
The low-temperature structure of Li S H
Winkler, B.; Hytha, M.; Milman, V.; Phase Transition 76 (2003) 187–195; doi:

data_1532758
_publ_section_title
;
 The low-temperature structure of Li S H
;
_journal_name_full               'Phase Transition'
_journal_page_first              187
_journal_page_last               195
_journal_volume                  76
_journal_year                    2003
_chemical_formula_sum            'H Li S'
_chemical_name_systematic        'Li S H'
_space_group_IT_number           40
_symmetry_space_group_name_Hall  'A 2 -2a'
_symmetry_space_group_name_H-M   'A m a 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.15687
_cell_length_b                   5.61841
_cell_length_c                   5.51478
_cell_volume                     190.766
_citation_journal_id_ASTM        PHTRDP
_cod_data_source_file            Winkler_PHTRDP_2003_579.cif
_cod_data_source_block           H1Li1S1
_cod_original_cell_volume        190.7663
_cod_original_formula_sum        'H1 Li1 S1'
_cod_database_code               1532758
Structural effects of Li and K additives on the columbite precursor and 0.9PMN - 0.1PT powders
Bruno, J.C.; Zaghete, M.A.; Cavalheiro, A.A.; Cilense, M.; Varela, J.A.; Materials Chemistry and Physics 84 (2004) 120–125; doi:

data_1532759
_publ_section_title
;
 Structural effects of Li and K additives on the columbite precursor and
 0.9PMN - 0.1PT powders
;
_journal_name_full               'Materials Chemistry and Physics'
_journal_page_first              120
_journal_page_last               125
_journal_volume                  84
_journal_year                    2004
_chemical_formula_sum            'Mg0.3 Nb0.6 O3 Pb Ti0.1'
_chemical_name_systematic        'Pb ((Mg0.3 Nb0.6 Ti0.1) O3)'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.0394
_cell_length_b                   4.0394
_cell_length_c                   4.0394
_cell_volume                     65.910
_citation_journal_id_ASTM        MCHPDR
_cod_data_source_file            Bruno_MCHPDR_2004_1895.cif
_cod_data_source_block           Mg0.3Nb0.6O3Pb1Ti0.1
_cod_original_cell_volume        65.9099
_cod_original_formula_sum        'Mg0.3 Nb0.6 O3 Pb1 Ti0.1'
_cod_database_code               1532759
High temperature crystallographic study of (La0.9 Sr0.1) M(III) O3-d (M(III) = Sc, In and Lu) perovskite proton conductor
Nomura, K.; Takeuchi, T.; Kageyama, H.; Miyazaki, Y.; Solid State Ionics 162 (2003) 99–104; doi:

data_1532760
_publ_section_title
;
 High temperature crystallographic study of (La0.9 Sr0.1) M(III) O3-d
 (M(III) = Sc, In and Lu) perovskite proton conductor
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              99
_journal_page_last               104
_journal_volume                  162
_journal_year                    2003
_chemical_formula_sum            'In La0.9 O2.95 Sr0.1'
_chemical_name_systematic        '(La0.9 Sr0.1) In O2.95'
_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                   5.9454
_cell_length_b                   8.2764
_cell_length_c                   5.77201
_cell_volume                     284.020
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Nomura_SSIOD3_2003_926.cif
_cod_data_source_block           In1La0.9O2.95Sr0.1
_cod_original_cell_volume        284.0204
_cod_original_formula_sum        'In1 La0.9 O2.95 Sr0.1'
_cod_database_code               1532760
Rietveld refinement studies of Te-doped Co Sb3
Wojciechowski, K.T.; Wegrzyn, Z.; Bucko, M.; Malecki, A.; Applied Crystallography: Proceedings of the XVII International Conference Wisla, Poland 31 August-4 September, 1997 18 (2001) 46–49; doi:

data_1532761
_publ_section_title
;
 Rietveld refinement studies of Te-doped Co Sb3
;
_journal_name_full
;
Applied Crystallography: Proceedings of the XVII International Conference 
Wisla, Poland 31 August-4 September, 1997
;
_journal_page_first              46
_journal_page_last               49
_journal_volume                  18
_journal_year                    2001
_chemical_formula_sum            'Co Sb2.997 Te0.003'
_chemical_name_systematic        'Co (Sb2.997 Te0.003)'
_space_group_IT_number           204
_symmetry_space_group_name_Hall  '-I 2 2 3'
_symmetry_space_group_name_H-M   'I m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.0339
_cell_length_b                   9.0339
_cell_length_c                   9.0339
_cell_volume                     737.269
_citation_journal_id_ASTM        APCRE2
_cod_data_source_file            Wojciechowski_APCRE2_2001_290.cif
_cod_data_source_block           Co1Sb2.997Te0.003
_cod_original_cell_volume        737.2689
_cod_original_formula_sum        'Co1 Sb2.997 Te0.003'
_cod_database_code               1532761
The cyrstal structure of gamma-Na2 Zr F6
Brunton, G.; Acta Crystallographica B (24,1968-38,1982) 25 (1969) 2164–2166; doi:

data_2106785
_publ_section_title
;
 The cyrstal structure of gamma-Na2 Zr F6
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2164
_journal_page_last               2166
_journal_volume                  25
_journal_year                    1969
_chemical_formula_sum            'F12 Na4 Zr2'
_chemical_name_systematic        'Na4 (Zr2 F12)'
_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                 95.886
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.5562
_cell_length_b                   5.4069
_cell_length_c                   16.073
_cell_volume                     480.316
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Brunton_ACBCAR_1969_1185.cif
_cod_data_source_block           F6Na2Zr1
_cod_depositor_comments
;

2023-05-16
Z value and formula fixed to values more according to usual
chemical conventions.                 miguel
;
_cod_original_formula_units_Z            4
_cod_original_cell_volume        480.3164
_cod_original_formula_sum        'F6 Na2 Zr1'
_cod_database_code               2106785
High temperature crystallographic study of (La0.9 Sr0.1) M(III) O3-d (M(III) = Sc, In and Lu) perovskite proton conductor
Nomura, K.; Miyazaki, Y.; Kageyama, H.; Takeuchi, T.; Solid State Ionics 162 (2003) 99–104; doi:

data_1532762
_publ_section_title
;
 High temperature crystallographic study of (La0.9 Sr0.1) M(III) O3-d
 (M(III) = Sc, In and Lu) perovskite proton conductor
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              99
_journal_page_last               104
_journal_volume                  162
_journal_year                    2003
_chemical_formula_sum            'La0.9 Lu O2.95 Sr0.1'
_chemical_name_systematic        '(La0.9 Sr0.1) Lu O2.95'
_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                   6.0382
_cell_length_b                   8.4245
_cell_length_c                   5.8616
_cell_volume                     298.173
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Nomura_SSIOD3_2003_927.cif
_cod_data_source_block           La0.9Lu1O2.95Sr0.1
_cod_original_cell_volume        298.1727
_cod_original_formula_sum        'La0.9 Lu1 O2.95 Sr0.1'
_cod_database_code               1532762
Phase equilibria, crystal structures and dielectric anomaly in the (Ba Zr O3) - (Ca Zr O3) system
Levin, I.; Roth, R.S.; Amos, T.G.; Farber, L.; Bell, S.M.; Toby, B.H.; Vanderah, T.A.; Journal of Solid State Chemistry 175 (2003) 170–181; doi:

data_1532763
_publ_section_title
;
 Phase equilibria, crystal structures and dielectric anomaly in the (Ba Zr
 O3) - (Ca Zr O3) system
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              170
_journal_page_last               181
_journal_volume                  175
_journal_year                    2003
_chemical_formula_sum            'Ba0.8 Ca0.2 O3 Zr'
_chemical_name_systematic        '(Ba0.8 Ca0.2) (Zr O3)'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.177
_cell_length_b                   4.177
_cell_length_c                   4.177
_cell_volume                     72.877
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Levin_JSSCBI_2003_173.cif
_cod_data_source_block           Ba0.8Ca0.2O3Zr1
_cod_original_cell_volume        72.87749
_cod_original_formula_sum        'Ba0.8 Ca0.2 O3 Zr1'
_cod_database_code               1532763
Rietveld refinement studies of Te-doped Co Sb3
Wojciechowski, K.T.; Bucko, M.; Wegrzyn, Z.; Malecki, A.; Applied Crystallography: Proceedings of the XVII International Conference Wisla, Poland 31 August-4 September, 1997 18 (2001) 46–49; doi:

data_1532764
_publ_section_title
;
 Rietveld refinement studies of Te-doped Co Sb3
;
_journal_name_full
;
Applied Crystallography: Proceedings of the XVII International Conference 
Wisla, Poland 31 August-4 September, 1997
;
_journal_page_first              46
_journal_page_last               49
_journal_volume                  18
_journal_year                    2001
_chemical_formula_sum            'Co Sb2.91 Te0.09'
_chemical_name_systematic        'Co (Sb2.91 Te0.09)'
_space_group_IT_number           204
_symmetry_space_group_name_Hall  '-I 2 2 3'
_symmetry_space_group_name_H-M   'I m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.0419
_cell_length_b                   9.0419
_cell_length_c                   9.0419
_cell_volume                     739.229
_citation_journal_id_ASTM        APCRE2
_cod_data_source_file            Wojciechowski_APCRE2_2001_291.cif
_cod_data_source_block           Co1Sb2.91Te0.09
_cod_original_cell_volume        739.2291
_cod_original_formula_sum        'Co1 Sb2.91 Te0.09'
_cod_database_code               1532764
The crystal structure of K Na Th F6
Brunton, G.; Acta Crystallographica B (24,1968-38,1982) 26 (1970) 1185–1187; doi:

data_2106786
_publ_section_title
;
 The crystal structure of K Na Th F6
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1185
_journal_page_last               1187
_journal_volume                  26
_journal_year                    1970
_chemical_formula_sum            'F6 K Na Th'
_chemical_name_systematic        'K Na Th F6'
_space_group_IT_number           147
_symmetry_space_group_name_Hall  '-P 3'
_symmetry_space_group_name_H-M   'P -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   6.3073
_cell_length_b                   6.3073
_cell_length_c                   7.8907
_cell_volume                     271.852
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Brunton_ACBCAR_1970_1245.cif
_cod_data_source_block           F6K1Na1Th1
_cod_original_cell_volume        271.8524
_cod_original_formula_sum        'F6 K1 Na1 Th1'
_cod_database_code               2106786
High-temperature synchrotron X-ray diffraction study of phases in a gamma Ti Al alloy
Novoselova, T.; Malinov, S.; Sha, W.; Zhecheva, A.; Materials Science and Engineering A 371 (2004) 103–112; doi:

data_1532765
_publ_section_title
;
 High-temperature synchrotron X-ray diffraction study of phases in a gamma
 Ti Al alloy
;
_journal_name_full               'Materials Science and Engineering A'
_journal_page_first              103
_journal_page_last               112
_journal_volume                  371
_journal_year                    2004
_chemical_formula_sum            Ti
_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                   2.9064
_cell_length_b                   2.9064
_cell_length_c                   4.6667
_cell_volume                     34.139
_citation_journal_id_ASTM        MSAPE3
_cod_data_source_file            Novoselova_MSAPE3_2004_1952.cif
_cod_data_source_block           Ti1
_cod_original_cell_volume        34.13904
_cod_original_formula_sum        Ti1
_cod_database_code               1532765
Rietveld refinement studies of Te-doped Co Sb3
Wojciechowski, K.T.; Bucko, M.; Wegrzyn, Z.; Malecki, A.; Applied Crystallography: Proceedings of the XVII International Conference Wisla, Poland 31 August-4 September, 1997 18 (2001) 46–49; doi:

data_1532766
_publ_section_title
;
 Rietveld refinement studies of Te-doped Co Sb3
;
_journal_name_full
;
Applied Crystallography: Proceedings of the XVII International Conference 
Wisla, Poland 31 August-4 September, 1997
;
_journal_page_first              46
_journal_page_last               49
_journal_volume                  18
_journal_year                    2001
_chemical_formula_sum            'Co Sb2.7 Te0.3'
_chemical_name_systematic        'Co (Sb2.7 Te0.3)'
_space_group_IT_number           204
_symmetry_space_group_name_Hall  '-I 2 2 3'
_symmetry_space_group_name_H-M   'I m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.0487
_cell_length_b                   9.0487
_cell_length_c                   9.0487
_cell_volume                     740.898
_citation_journal_id_ASTM        APCRE2
_cod_data_source_file            Wojciechowski_APCRE2_2001_292.cif
_cod_data_source_block           Co1Sb2.7Te0.3
_cod_original_cell_volume        740.8983
_cod_original_formula_sum        'Co1 Sb2.7 Te0.3'
_cod_database_code               1532766
The Crystal Structure of Rb Th3 F13
Brunton, G.; Acta Crystallographica B (24,1968-38,1982) 27 (1971) 1823–1826; doi:

data_2106787
_publ_section_title
;
 The Crystal Structure of Rb Th3 F13
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1823
_journal_page_last               1826
_journal_volume                  27
_journal_year                    1971
_chemical_formula_sum            'F13 Rb Th3'
_chemical_name_systematic        'Rb Th3 F13'
_space_group_IT_number           26
_symmetry_space_group_name_Hall  'P -2a 2a'
_symmetry_space_group_name_H-M   'P 21 m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.649
_cell_length_b                   8.176
_cell_length_c                   7.4453
_cell_volume                     526.489
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Brunton_ACBCAR_1971_1414.cif
_cod_data_source_block           F13Rb1Th3
_cod_original_cell_volume        526.4886
_cod_original_sg_symbol_Hall     'P 2c -2 (z,x,y)'
_cod_original_formula_sum        'F13 Rb1 Th3'
_cod_database_code               2106787
High-temperature synchrotron X-ray diffraction study of phases in a gamma Ti Al alloy
Novoselova, T.; Malinov, S.; Sha, W.; Zhecheva, A.; Materials Science and Engineering A 371 (2004) 103–112; doi:

data_1532767
_publ_section_title
;
 High-temperature synchrotron X-ray diffraction study of phases in a gamma
 Ti Al alloy
;
_journal_name_full               'Materials Science and Engineering A'
_journal_page_first              103
_journal_page_last               112
_journal_volume                  371
_journal_year                    2004
_chemical_formula_sum            'Al Ti3'
_chemical_name_systematic        'Ti3 Al'
_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                   5.764
_cell_length_b                   5.764
_cell_length_c                   4.664
_cell_volume                     134.195
_citation_journal_id_ASTM        MSAPE3
_cod_data_source_file            Novoselova_MSAPE3_2004_1953.cif
_cod_data_source_block           Al1Ti3
_cod_original_cell_volume        134.1952
_cod_original_formula_sum        'Al1 Ti3'
_cod_database_code               1532767
Synthesis, structure and characterization of a cubic thallium cluster phase of the Bergman type, Na13 (Cd0.7 Tl0.3)27
Li Bin; Corbett, J.D.; Inorganic Chemistry 43 (2004) 3582–3587; doi:

data_4344155
_publ_section_title
;
 Synthesis, structure and characterization of a cubic thallium cluster
 phase of the Bergman type, Na13 (Cd0.7 Tl0.3)27
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3582
_journal_page_last               3587
_journal_volume                  43
_journal_year                    2004
_chemical_formula_sum            'Cd20.42 Na13 Tl6.58'
_chemical_name_systematic        'Na13 (Cd20.42 Tl6.58)'
_space_group_IT_number           204
_symmetry_space_group_name_Hall  '-I 2 2 3'
_symmetry_space_group_name_H-M   'I m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.874
_cell_length_b                   15.874
_cell_length_c                   15.874
_cell_volume                     3999.992
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            LiBin_INOCAJ_2004_1292.cif
_cod_data_source_block           Cd20.42Na13Tl6.58
_cod_database_code               4344155
Crystal structures and reference diffraction patterns of Ba Sr R4 O9
Wong-Ng, W.; Kaduk, J.A.; Dillingham, J.; Powder Diffraction 17 (2002) 202–209; doi:

data_1532768
_publ_section_title
;
 Crystal structures and reference diffraction patterns of Ba Sr R4 O9
;
_journal_name_full               'Powder Diffraction'
_journal_page_first              202
_journal_page_last               209
_journal_volume                  17
_journal_year                    2002
_chemical_formula_sum            'Ba O8 Sr Y4'
_chemical_name_systematic        'Ba Sr Y4 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            2
_cell_length_a                   10.2434
_cell_length_b                   3.43107
_cell_length_c                   12.0221
_cell_volume                     422.527
_citation_journal_id_ASTM        PODIE2
_cod_data_source_file            Wong-Ng_PODIE2_2002_1.cif
_cod_data_source_block           Ba1O8Sr1Y4
_cod_original_cell_volume        422.5266
_cod_original_formula_sum        'Ba1 O8 Sr1 Y4'
_cod_database_code               1532768
The Crystal Structure of Rb5 Zr4 F21
Brunton, G.; Acta Crystallographica B (24,1968-38,1982) 27 (1971) 1944–1948; doi:

data_2106788
_publ_section_title
;
 The Crystal Structure of Rb5 Zr4 F21
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1944
_journal_page_last               1948
_journal_volume                  27
_journal_year                    1971
_chemical_formula_sum            'F21 Rb5 Zr4'
_chemical_name_systematic        'Rb5 Zr4 F21'
_space_group_IT_number           4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 98.3
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   11.52
_cell_length_b                   11.222
_cell_length_c                   7.868
_cell_volume                     1006.501
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Brunton_ACBCAR_1971_1421.cif
_cod_data_source_block           F21Rb5Zr4
_cod_database_code               2106788
High-temperature synchrotron X-ray diffraction study of phases in a gamma Ti Al alloy
Novoselova, T.; Malinov, S.; Sha, W.; Zhecheva, A.; Materials Science and Engineering A 371 (2004) 103–112; doi:

data_1532769
_publ_section_title
;
 High-temperature synchrotron X-ray diffraction study of phases in a gamma
 Ti Al alloy
;
_journal_name_full               'Materials Science and Engineering A'
_journal_page_first              103
_journal_page_last               112
_journal_volume                  371
_journal_year                    2004
_chemical_formula_sum            'Al Ti'
_chemical_name_systematic        'Ti Al'
_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                   2.8373
_cell_length_b                   2.8373
_cell_length_c                   4.0591
_cell_volume                     32.677
_citation_journal_id_ASTM        MSAPE3
_cod_data_source_file            Novoselova_MSAPE3_2004_1955.cif
_cod_data_source_block           Al1Ti1
_cod_original_cell_volume        32.67686
_cod_original_formula_sum        'Al1 Ti1'
_cod_database_code               1532769