LMucko/crystallography-open-database huggingface dataset:
Phase equilibrium of the Al-Zn-La system at 573 K
Ikromov, A.Z.; Kinjibalo, V.V.; Ganiev, I.N.; Doklady Akademii Nauk Tadzhikskoi SSR 33 (1990) 173–176; doi:

data_1523891
_publ_section_title
;
 Phase equilibrium of the Al-Zn-La system at 573 K
;
_journal_name_full               'Doklady Akademii Nauk Tadzhikskoi SSR'
_journal_page_first              173
_journal_page_last               176
_journal_volume                  33
_journal_year                    1990
_chemical_formula_sum            'Al0.5 La Zn0.5'
_chemical_name_systematic        'La (Al0.5 Zn0.5)'
_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                   3.794
_cell_length_b                   3.794
_cell_length_c                   3.794
_cell_volume                     54.612
_citation_journal_id_ASTM        DANTAL
_cod_data_source_file            Ikromov_DANTAL_1990_1607.cif
_cod_data_source_block           Al0.5La1Zn0.5
_cod_original_cell_volume        54.61249
_cod_original_formula_sum        'Al0.5 La1 Zn0.5'
_cod_database_code               1523891
Phase equilibrium of the Al-Zn-La system at 573 K
Ikromov, A.Z.; Ganiev, I.N.; Kinjibalo, V.V.; Doklady Akademii Nauk Tadzhikskoi SSR 33 (1990) 173–176; doi:

data_1523892
_publ_section_title
;
 Phase equilibrium of the Al-Zn-La system at 573 K
;
_journal_name_full               'Doklady Akademii Nauk Tadzhikskoi SSR'
_journal_page_first              173
_journal_page_last               176
_journal_volume                  33
_journal_year                    1990
_chemical_formula_sum            'Al2 La Zn2'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.292
_cell_length_b                   4.292
_cell_length_c                   11.015
_cell_volume                     202.910
_citation_journal_id_ASTM        DANTAL
_cod_data_source_file            Ikromov_DANTAL_1990_1608.cif
_cod_data_source_block           Al2La1Zn2
_cod_original_cell_volume        202.9102
_cod_original_formula_sum        'Al2 La1 Zn2'
_cod_database_code               1523892
Phase diagram of the LaS-SmS system
Ilmenkov, G.V.; Golubkov, A.V.; Sergeeva, V.M.; Bach, H.; Methfessel, S.; Journal of the Less-Common Metals 152 (1989) 47–50; doi:

data_1523893
_publ_section_title
;
 Phase diagram of the LaS-SmS system
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              47
_journal_page_last               50
_journal_volume                  152
_journal_year                    1989
_chemical_formula_sum            'La S2 Sm'
_chemical_name_systematic        '(La Sm) S2'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.832
_cell_length_b                   5.832
_cell_length_c                   5.832
_cell_volume                     198.359
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Ilmenkov_JCOMAH_1989_944.cif
_cod_data_source_block           La1S2Sm1
_cod_original_cell_volume        198.3593
_cod_original_sg_symbol_Hall     '-F 4vw 2vw 3 (x+1/8,y+1/8,z+1/8)'
_cod_original_formula_sum        'La1 S2 Sm1'
_cod_database_code               1523893
Solid solubility in Na Cl-type uranium compounds
Imoto, S.; Niihara, K.; Stoecker, H.J.; Thermodyn. Nucl. Mater., Proc. Symp., Vienna 1967 (1968) 371–383; doi:

data_1523894
_publ_section_title
;
 Solid solubility in Na Cl-type uranium compounds
;
_journal_name_full
'Thermodyn. Nucl. Mater., Proc. Symp., Vienna'
_journal_page_first              371
_journal_page_last               383
_journal_volume                  1967
_journal_year                    1968
_chemical_formula_sum            'N0.73 Si0.27 U'
_chemical_name_systematic        'U (N0.73 Si0.27)'
_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                   4.9003
_cell_length_b                   4.9003
_cell_length_c                   4.9003
_cell_volume                     117.671
_citation_journal_id_ASTM        20EZAR
_cod_data_source_file            Imoto_20EZAR_1968_1310.cif
_cod_data_source_block           N0.73Si0.27U1
_cod_original_cell_volume        117.6706
_cod_original_formula_sum        'N0.73 Si0.27 U1'
_cod_database_code               1523894
Solid solubility in Na Cl-type uranium compounds
Imoto, S.; Niihara, K.; Stoecker, H.J.; Thermodyn. Nucl. Mater., Proc. Symp., Vienna 1967 (1968) 371–383; doi:

data_1523895
_publ_section_title
;
 Solid solubility in Na Cl-type uranium compounds
;
_journal_name_full
'Thermodyn. Nucl. Mater., Proc. Symp., Vienna'
_journal_page_first              371
_journal_page_last               383
_journal_volume                  1967
_journal_year                    1968
_chemical_formula_sum            'P0.83 Si0.17 U'
_chemical_name_systematic        'U (P0.83 Si0.17)'
_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                   5.6016
_cell_length_b                   5.6016
_cell_length_c                   5.6016
_cell_volume                     175.767
_citation_journal_id_ASTM        20EZAR
_cod_data_source_file            Imoto_20EZAR_1968_1671.cif
_cod_data_source_block           P0.83Si0.17U1
_cod_original_cell_volume        175.7666
_cod_original_formula_sum        'P0.83 Si0.17 U1'
_cod_database_code               1523895
Lattice parameter and melting behavior of the ternary B2-phase in the Co-Ga-Ni system
Ipser, H.; Mikula, A.; Schuster, W.; Monatshefte fuer Chemie (-108,1977) 120 (1989) 283–289; doi:

data_1523896
_publ_section_title
;
 Lattice parameter and melting behavior of the ternary B2-phase in the
 Co-Ga-Ni system
;
_journal_name_full               'Monatshefte fuer Chemie (-108,1977)'
_journal_page_first              283
_journal_page_last               289
_journal_volume                  120
_journal_year                    1989
_chemical_formula_sum            'Ga Ni'
_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                   2.892
_cell_length_b                   2.892
_cell_length_c                   2.892
_cell_volume                     24.188
_citation_journal_id_ASTM        MOCHAP
_cod_data_source_file            Ipser_MOCHAP_1989_256.cif
_cod_data_source_block           Ga1Ni1
_cod_original_cell_volume        24.18772
_cod_original_formula_sum        'Ga1 Ni1'
_cod_database_code               1523896
On the ternary B2-phase in the Al-Co-Ga system
Ipser, H.; Mikula, A.; Monatshefte fuer Chemie (-108,1977) 123 (1992) 509–513; doi:

data_1523897
_publ_section_title
;
 On the ternary B2-phase in the Al-Co-Ga system
;
_journal_name_full               'Monatshefte fuer Chemie (-108,1977)'
_journal_page_first              509
_journal_page_last               513
_journal_volume                  123
_journal_year                    1992
_chemical_formula_sum            'Al0.5 Co Ga0.5'
_chemical_name_systematic        '(Al0.5 Ga0.5) Co'
_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                   2.874
_cell_length_b                   2.874
_cell_length_c                   2.874
_cell_volume                     23.739
_citation_journal_id_ASTM        MOCHAP
_cod_data_source_file            Ipser_MOCHAP_1992_886.cif
_cod_data_source_block           Al0.5Co1Ga0.5
_cod_original_cell_volume        23.73889
_cod_original_formula_sum        'Al0.5 Co1 Ga0.5'
_cod_database_code               1523897
Sn diffusion effects on X-ray diffraction patterns of Pb1-x Snc Te - Pb Sey Te1-y superlattices
Ishida, A.; Fujiyasu, H.; Aoki, M.; Journal of Applied Physics 58 (1985) 798–801; doi:

data_1523898
_publ_section_title
;
 Sn diffusion effects on X-ray diffraction patterns of Pb1-x Snc Te - Pb
 Sey Te1-y superlattices
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              798
_journal_page_last               801
_journal_volume                  58
_journal_year                    1985
_chemical_formula_sum            'Pb0.76 Sn0.24 Te'
_chemical_name_systematic        '(Pb0.76 Sn0.24) Te'
_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                   6.427
_cell_length_b                   6.427
_cell_length_c                   6.427
_cell_volume                     265.476
_citation_journal_id_ASTM        JAPIAU
_cod_data_source_file            Ishida_JAPIAU_1985_1701.cif
_cod_data_source_block           Pb0.76Sn0.24Te1
_cod_original_cell_volume        265.4758
_cod_original_formula_sum        'Pb0.76 Sn0.24 Te1'
_cod_database_code               1523898
New ternary superconductors of the Y Pd2 Sn-type
Ishikawa, M.; Jorda, J.L.; Junod, A.; Conference on Superconducting D-F-Band Metals: Proceedings 4th 1982 1982 (1982) 141–144; doi:

data_1523899
_publ_section_title
;
 New ternary superconductors of the Y Pd2 Sn-type
;
_journal_name_full
;
Conference on Superconducting D-F-Band Metals: Proceedings 4th 1982
;
_journal_page_first              141
_journal_page_last               144
_journal_volume                  1982
_journal_year                    1982
_chemical_formula_sum            'Pd2 Sb Y'
_chemical_name_systematic        'Pd2 (Sb Y)'
_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                   6.691
_cell_length_b                   6.691
_cell_length_c                   6.691
_cell_volume                     299.553
_citation_journal_id_ASTM        50IDAE
_cod_data_source_file            Ishikawa_50IDAE_1982_1740.cif
_cod_data_source_block           Pd2Sb1Y1
_cod_original_cell_volume        299.5526
_cod_original_formula_sum        'Pd2 Sb1 Y1'
_cod_database_code               1523899
Magnetic properties and neutron diffraction measurements of dense-Kondo compound Ce Ni2 Al5
Isikawa, Y.; Oliveira, I.S.; Mizushima, A.; Sakurai, J.; Givord, F.; Munoz, A.; Mori, K.; Voiron, J.; Boucherle, J.X.; Flouquet, J.; Journal of the Physical Society of Japan 63 (1994) 2349–2358; doi:

data_1523900
_publ_section_title
;
 Magnetic properties and neutron diffraction measurements of dense-Kondo
 compound Ce Ni2 Al5
;
_journal_name_full               'Journal of the Physical Society of Japan'
_journal_page_first              2349
_journal_page_last               2358
_journal_volume                  63
_journal_year                    1994
_chemical_formula_sum            'Al5 Ce Ni2'
_space_group_IT_number           71
_symmetry_space_group_name_Hall  '-I 2 2'
_symmetry_space_group_name_H-M   'I m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.006
_cell_length_b                   9.566
_cell_length_c                   3.988
_cell_volume                     267.273
_citation_journal_id_ASTM        JUPSAU
_cod_data_source_file            Isikawa_JUPSAU_1994_872.cif
_cod_data_source_block           Al5Ce1Ni2
_cod_original_cell_volume        267.2733
_cod_original_formula_sum        'Al5 Ce1 Ni2'
_cod_database_code               1523900
High pressure X-ray diffraction on U X2 compounds
Itie, J.P.; Staun Olsen, J.; Gerward, L.; Spirlet, J.C.; Benedict, U.; Physica B and C (Netherland) (79,1975-) 139 (1986) 330–332; doi:

data_1523901
_publ_section_title
;
 High pressure X-ray diffraction on U X2 compounds
;
_journal_name_full               'Physica B and C (Netherland) (79,1975-)'
_journal_page_first              330
_journal_page_last               332
_journal_volume                  139
_journal_year                    1986
_chemical_formula_sum            'Ir2 U'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.4954
_cell_length_b                   7.4954
_cell_length_c                   7.4954
_cell_volume                     421.099
_citation_journal_id_ASTM        PHBCDQ
_cod_data_source_file            Itie_PHBCDQ_1986_833.cif
_cod_data_source_block           Ir2U1
_cod_original_cell_volume        421.0992
_cod_original_sg_symbol_Hall     '-F 4vw 2vw 3 (x+1/8,y+1/8,z+1/8)'
_cod_original_formula_sum        'Ir2 U1'
_cod_database_code               1523901
Lattice modulation in the long period ordered alloys studied by X-ray diffraction. IV. Pd3 Mn
Iwasaki, H.; Okumura, K.; Ogawa, S.; Journal of the Physical Society of Japan 31 (1971) 497–505; doi:

data_1523902
_publ_section_title
;
 Lattice modulation in the long period ordered alloys studied by X-ray
 diffraction. IV. Pd3 Mn
;
_journal_name_full               'Journal of the Physical Society of Japan'
_journal_page_first              497
_journal_page_last               505
_journal_volume                  31
_journal_year                    1971
_chemical_formula_sum            'Mn Pd3'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   3.913
_cell_length_b                   3.913
_cell_length_c                   15.496
_cell_volume                     237.268
_citation_journal_id_ASTM        JUPSAU
_cod_data_source_file            Iwasaki_JUPSAU_1971_1147.cif
_cod_data_source_block           Mn1Pd3
_cod_original_cell_volume        237.2681
_cod_original_formula_sum        'Mn1 Pd3'
_cod_database_code               1523902
Covalency parameters in Mn Se and Mn Se2
Jacobson, A.J.; Fender, B.E.F.; Journal of Chemical Physics 52 (1970) 4563–4566; doi:

data_1523903
_publ_section_title
;
 Covalency parameters in Mn Se and Mn Se2
;
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              4563
_journal_page_last               4566
_journal_volume                  52
_journal_year                    1970
_chemical_formula_sum            'Mg0.1 Mn0.9 Se'
_chemical_name_systematic        '(Mg0.1 Mn0.9) Se'
_space_group_IT_number           216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.4634
_cell_length_b                   5.4634
_cell_length_c                   5.4634
_cell_volume                     163.076
_citation_journal_id_ASTM        JCPSA6
_cod_data_source_file            Jacobson_JCPSA6_1970_1054.cif
_cod_data_source_block           Mg0.1Mn0.9Se1
_cod_original_cell_volume        163.0756
_cod_original_formula_sum        'Mg0.1 Mn0.9 Se1'
_cod_database_code               1523903
Structure and ordering of solid solutions of iron in palladium
Jaeaeskelaeinen, J.; Suoninen, E.; Physica Status Solidi, Sectio A: Applied Research 63 (1981) 241–245; doi:

data_1523904
_publ_section_title
;
 Structure and ordering of solid solutions of iron in palladium
;
_journal_name_full
'Physica Status Solidi, Sectio A: Applied Research'
_journal_page_first              241
_journal_page_last               245
_journal_volume                  63
_journal_year                    1981
_chemical_formula_sum            'Fe Pd3'
_chemical_name_systematic        '(Fe Pd3)'
_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            1
_cell_length_a                   3.849
_cell_length_b                   3.849
_cell_length_c                   3.849
_cell_volume                     57.022
_citation_journal_id_ASTM        PSSABA
_cod_data_source_file            Jaeaeskelaeinen_PSSABA_1981_21.cif
_cod_data_source_block           Fe1Pd3
_cod_original_cell_volume        57.02217
_cod_original_formula_sum        'Fe1 Pd3'
_cod_database_code               1523904
The effect of stoichiometeric variations on the magnetic structure of Y6 Mn23
James, W.J.; van Schalkwyk, T.G.D.; Crowder, C.E.; Journal of the Less-Common Metals 94 (1983) 221–225; doi:

data_1523905
_publ_section_title
;
 The effect of stoichiometeric variations on the magnetic structure of Y6
 Mn23
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              221
_journal_page_last               225
_journal_volume                  94
_journal_year                    1983
_chemical_formula_sum            'Mn22.1 Y6'
_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                   12.5061
_cell_length_b                   12.5061
_cell_length_c                   12.5061
_cell_volume                     1955.986
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            James_JCOMAH_1983_1193.cif
_cod_data_source_block           Mn22.1Y6
_cod_database_code               1523905
The effect of stoichiometeric variations on the magnetic structure of Y6 Mn23
James, W.J.; van Schalkwyk, T.G.D.; Crowder, C.E.; Journal of the Less-Common Metals 94 (1983) 221–225; doi:

data_1523906
_publ_section_title
;
 The effect of stoichiometeric variations on the magnetic structure of Y6
 Mn23
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              221
_journal_page_last               225
_journal_volume                  94
_journal_year                    1983
_chemical_formula_sum            'Mn22.8 Y6'
_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                   12.3931
_cell_length_b                   12.3931
_cell_length_c                   12.3931
_cell_volume                     1903.443
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            James_JCOMAH_1983_1194.cif
_cod_data_source_block           Mn22.8Y6
_cod_database_code               1523906
The effect of stoichiometeric variations on the magnetic structure of Y6 Mn23
James, W.J.; Crowder, C.E.; van Schalkwyk, T.G.D.; Journal of the Less-Common Metals 94 (1983) 221–225; doi:

data_1523907
_publ_section_title
;
 The effect of stoichiometeric variations on the magnetic structure of Y6
 Mn23
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              221
_journal_page_last               225
_journal_volume                  94
_journal_year                    1983
_chemical_formula_sum            'Mn23 Y5.91'
_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                   12.4009
_cell_length_b                   12.4009
_cell_length_c                   12.4009
_cell_volume                     1907.039
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            James_JCOMAH_1983_1195.cif
_cod_data_source_block           Mn23Y5.91
_cod_database_code               1523907
The effect of stoichiometeric variations on the magnetic structure of Y6 Mn23
James, W.J.; van Schalkwyk, T.G.D.; Crowder, C.E.; Journal of the Less-Common Metals 94 (1983) 221–225; doi:

data_1523908
_publ_section_title
;
 The effect of stoichiometeric variations on the magnetic structure of Y6
 Mn23
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              221
_journal_page_last               225
_journal_volume                  94
_journal_year                    1983
_chemical_formula_sum            'Mn23 Y6'
_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                   12.4939
_cell_length_b                   12.4939
_cell_length_c                   12.4939
_cell_volume                     1950.267
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            James_JCOMAH_1983_1196.cif
_cod_data_source_block           Mn23Y6
_cod_database_code               1523908
The effect of stoichiometeric variations on the magnetic structure of Y6 Mn23
James, W.J.; van Schalkwyk, T.G.D.; Crowder, C.E.; Journal of the Less-Common Metals 94 (1983) 221–225; doi:

data_1523909
_publ_section_title
;
 The effect of stoichiometeric variations on the magnetic structure of Y6
 Mn23
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              221
_journal_page_last               225
_journal_volume                  94
_journal_year                    1983
_chemical_formula_sum            'Mn22 Y6'
_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                   12.4834
_cell_length_b                   12.4834
_cell_length_c                   12.4834
_cell_volume                     1945.354
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