LMucko/crystallography-open-database huggingface dataset:
New Dion-Jacobson-type layered perovskite oxyfluorides, A Sr Nb2 O6 F (A = Li, Na and Rb)
Choy, J.-H.; Kim, S.-J.; Kim, J.-Y.; Sohn, J.-S.; Chemistry of Materials (1,1989-) 13 (2001) 906–912; doi:

data_4002315
_publ_section_title
;
 New Dion-Jacobson-type layered perovskite oxyfluorides, A Sr Nb2 O6 F (A
 = Li, Na and Rb)
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              906
_journal_page_last               912
_journal_volume                  13
_journal_year                    2001
_chemical_formula_sum            'F Li0.9 Nb2 O6 Sr'
_chemical_name_systematic        'Li0.9 Sr (Nb2 O6 F)'
_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                   3.8304
_cell_length_b                   3.8304
_cell_length_c                   20.837
_cell_volume                     305.720
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Choy_CMATEX_2001_964.cif
_cod_data_source_block           F1Li0.9Nb2O6Sr1
_cod_original_cell_volume        305.7197
_cod_original_formula_sum        'F1 Li0.9 Nb2 O6 Sr1'
_cod_database_code               4002315
Crystal structure of La Ba2 Cu3 O7 with Fe-doping
Lin, J.; Jiang, S.-S.; Wu, X.-S.; Chen, W.-M.; Diwen Wuli Xuebao 20 (1998) 7–14; doi:

data_1525793
_publ_section_title
;
 Crystal structure of La Ba2 Cu3 O7 with Fe-doping
;
_journal_name_full               'Diwen Wuli Xuebao'
_journal_page_first              7
_journal_page_last               14
_journal_volume                  20
_journal_year                    1998
_chemical_formula_sum            'Ba2 Cu2.75 Fe0.25 La O7.03'
_chemical_name_systematic
'La Ba2 (Cu0.82 Fe0.18) (Cu1.93 Fe0.07) O7.03'
_space_group_IT_number           47
_symmetry_space_group_name_Hall  '-P 2 2'
_symmetry_space_group_name_H-M   'P m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.9173
_cell_length_b                   3.9332
_cell_length_c                   11.788
_cell_volume                     181.624
_citation_journal_id_ASTM        DWXUES
_cod_data_source_file            Lin_DWXUES_1998_96.cif
_cod_data_source_block           Ba2Cu2.75Fe0.25La1O7.03
_cod_original_cell_volume        181.6239
_cod_original_formula_sum        'Ba2 Cu2.75 Fe0.25 La1 O7.03'
_cod_database_code               1525793
Neutron diffraction and X-ray absorption spectroscopic analyses for lithiated Aurivillius-type layered perovskite oxide, Li2 Bi4 Ti3 O12
Choy, J.-H.; Chung, I.; Kim, J.-Y.; J. Phys. Chem. B 105 (2001) 7908–7912; doi:

data_1525794
_publ_section_title
;
 Neutron diffraction and X-ray absorption spectroscopic analyses for
 lithiated Aurivillius-type layered perovskite oxide, Li2 Bi4 Ti3 O12
;
_journal_name_full               'J. Phys. Chem. B'
_journal_page_first              7908
_journal_page_last               7912
_journal_volume                  105
_journal_year                    2001
_chemical_formula_sum            'Bi4 Li2 O12 Ti3'
_chemical_name_systematic        'Li2 Bi4 Ti3 O12'
_space_group_IT_number           41
_symmetry_space_group_name_Hall  'A 2 -2ab'
_symmetry_space_group_name_H-M   'A b a 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.4091
_cell_length_b                   32.785
_cell_length_c                   5.4428
_cell_volume                     965.212
_citation_journal_id_ASTM        JPCBFK
_cod_data_source_file            Choy_JPCBFK_2001_1435.cif
_cod_data_source_block           Bi4Li2O12Ti3
_cod_original_cell_volume        965.2117
_cod_database_code               1525794
Crystal structure of La Ba2 Cu3 O7 with Fe-doping
Lin, J.; Wu, X.-S.; Chen, W.-M.; Jiang, S.-S.; Diwen Wuli Xuebao 20 (1998) 7–14; doi:

data_1525795
_publ_section_title
;
 Crystal structure of La Ba2 Cu3 O7 with Fe-doping
;
_journal_name_full               'Diwen Wuli Xuebao'
_journal_page_first              7
_journal_page_last               14
_journal_volume                  20
_journal_year                    1998
_chemical_formula_sum            'Ba2 Cu2.4 Fe0.6 La O7.5'
_chemical_name_systematic        'La Ba2 (Cu0.57 Fe0.43) (Cu1.83 Fe0.17) O7.5'
_space_group_IT_number           47
_symmetry_space_group_name_Hall  '-P 2 2'
_symmetry_space_group_name_H-M   'P m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.9141
_cell_length_b                   3.9373
_cell_length_c                   11.803
_cell_volume                     181.896
_citation_journal_id_ASTM        DWXUES
_cod_data_source_file            Lin_DWXUES_1998_97.cif
_cod_data_source_block           Ba2Cu2.4Fe0.6La1O7.5
_cod_original_cell_volume        181.8959
_cod_original_formula_sum        'Ba2 Cu2.4 Fe0.6 La1 O7.5'
_cod_database_code               1525795
Analyse par diffraction des rayons X, methode de Rietveld, de la structure des solutions solides (1-x)(A2 Ti2 O7)-x(Fe2 Ti O5), A = Eu, Y
Chtoun, E.; Hanebali, L.; Garnier, P.; Annales de Chimie (Paris) 26 (2001) 27–32; doi:

data_1525796
_publ_section_title
;
 Analyse par diffraction des rayons X, methode de Rietveld, de la
 structure des solutions solides (1-x)(A2 Ti2 O7)-x(Fe2 Ti O5), A = Eu, Y
;
_journal_name_full               'Annales de Chimie (Paris)'
_journal_page_first              27
_journal_page_last               32
_journal_volume                  26
_journal_year                    2001
_chemical_formula_sum            'Eu1.34 Fe0.66 O6.34 Ti2'
_chemical_name_systematic        '(Eu1.34 Fe0.66) Ti2 O6.34'
_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                   10.1789
_cell_length_b                   10.1789
_cell_length_c                   10.1789
_cell_volume                     1054.636
_citation_journal_id_ASTM        ANCPAC
_cod_data_source_file            Chtoun_ANCPAC_2001_906.cif
_cod_data_source_block           Eu1.34Fe0.66O6.34Ti2
_cod_database_code               1525796
Crystal structure of La Ba2 Cu3 O7 with Fe-doping
Lin, J.; Wu, X.-S.; Jiang, S.-S.; Chen, W.-M.; Diwen Wuli Xuebao 20 (1998) 7–14; doi:

data_1525797
_publ_section_title
;
 Crystal structure of La Ba2 Cu3 O7 with Fe-doping
;
_journal_name_full               'Diwen Wuli Xuebao'
_journal_page_first              7
_journal_page_last               14
_journal_volume                  20
_journal_year                    1998
_chemical_formula_sum            'Ba2 Cu2 Fe La O7.9'
_chemical_name_systematic        'La Ba2 (Cu0.36 Fe0.64) (Cu1.64 Fe0.36) O7.9'
_space_group_IT_number           47
_symmetry_space_group_name_Hall  '-P 2 2'
_symmetry_space_group_name_H-M   'P m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.924
_cell_length_b                   3.9392
_cell_length_c                   11.817
_cell_volume                     182.660
_citation_journal_id_ASTM        DWXUES
_cod_data_source_file            Lin_DWXUES_1998_98.cif
_cod_data_source_block           Ba2Cu2Fe1La1O7.9
_cod_original_cell_volume        182.6603
_cod_original_formula_sum        'Ba2 Cu2 Fe1 La1 O7.9'
_cod_database_code               1525797
Analyse par diffraction des rayons X, methode de Rietveld, de la structure des solutions solides (1-x)(A2 Ti2 O7)-x(Fe2 Ti O5), A = Eu, Y
Chtoun, E.; Hanebali, L.; Garnier, P.; Annales de Chimie (Paris) 26 (2001) 27–32; doi:

data_1525798
_publ_section_title
;
 Analyse par diffraction des rayons X, methode de Rietveld, de la
 structure des solutions solides (1-x)(A2 Ti2 O7)-x(Fe2 Ti O5), A = Eu, Y
;
_journal_name_full               'Annales de Chimie (Paris)'
_journal_page_first              27
_journal_page_last               32
_journal_volume                  26
_journal_year                    2001
_chemical_formula_sum            'Fe0.4 O6.6 Ti1.8 Y1.6'
_chemical_name_systematic        '(Y1.6 Fe0.4) Ti1.8 O6.6'
_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                   10.0949
_cell_length_b                   10.0949
_cell_length_c                   10.0949
_cell_volume                     1028.741
_citation_journal_id_ASTM        ANCPAC
_cod_data_source_file            Chtoun_ANCPAC_2001_908.cif
_cod_data_source_block           Fe0.4O6.6Ti1.8Y1.6
_cod_database_code               1525798
Crystal structure of La Ba2 Cu3 O7 with Fe-doping
Lin, J.; Chen, W.-M.; Wu, X.-S.; Jiang, S.-S.; Diwen Wuli Xuebao 20 (1998) 7–14; doi:

data_1525799
_publ_section_title
;
 Crystal structure of La Ba2 Cu3 O7 with Fe-doping
;
_journal_name_full               'Diwen Wuli Xuebao'
_journal_page_first              7
_journal_page_last               14
_journal_volume                  20
_journal_year                    1998
_chemical_formula_sum            'Ba2 Cu1.5 Fe1.5 La O8.24'
_chemical_name_systematic
'La Ba2 (Cu0.18 Fe0.82) (Cu1.32 Fe0.68) O8.24'
_space_group_IT_number           47
_symmetry_space_group_name_Hall  '-P 2 2'
_symmetry_space_group_name_H-M   'P m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.9454
_cell_length_b                   3.9454
_cell_length_c                   11.833
_cell_volume                     184.195
_citation_journal_id_ASTM        DWXUES
_cod_data_source_file            Lin_DWXUES_1998_99.cif
_cod_data_source_block           Ba2Cu1.5Fe1.5La1O8.24
_cod_original_cell_volume        184.1946
_cod_original_formula_sum        'Ba2 Cu1.5 Fe1.5 La1 O8.24'
_cod_database_code               1525799
A neutron diffraction study of the deuterium site occupancy in Nd5 Fe17 D15.5
Chu, Z.; Yelon, W.B.; da Silva, P.S.M.; Murakami, R.K.; Villas-Boas, V.; Missell, F.P.; IEEE Transactions on Magnetics 37 (2001) 2172–2175; doi:

data_1525800
_publ_section_title
;
 A neutron diffraction study of the deuterium site occupancy in Nd5 Fe17
 D15.5
;
_journal_name_full               'IEEE Transactions on Magnetics'
_journal_page_first              2172
_journal_page_last               2175
_journal_volume                  37
_journal_year                    2001
_chemical_formula_sum            'D17.387 Fe17 Nd5'
_chemical_name_systematic        'Nd5 Fe17 D17.387'
_space_group_IT_number           193
_symmetry_space_group_name_Hall  '-P 6c 2'
_symmetry_space_group_name_H-M   'P 63/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            12
_cell_length_a                   21.188
_cell_length_b                   21.188
_cell_length_c                   12.8828
_cell_volume                     5008.652
_citation_journal_id_ASTM        IEMGAQ
_cod_data_source_file            Chu_IEMGAQ_2001_1047.cif
_cod_data_source_block           D17.387Fe17Nd5
_cod_original_cell_volume        5008.651
_cod_database_code               1525800
Hydrothermal synthesis and structure of a novel molybdenum phosphate: Na4 (H3 O) (Na (H P O4)2 (P O4)4 Mo18 O49) * 16(H2 O)
Lin, Z.-Z.; Zhang, H.-H.; Huang, C.-C.; Wu, X.-Y.; Zhao, S.-L.; Sun, R.-Q.; Lin, Z.-H.; Jiegon Huaxue 20 (2001) 447–450; doi:

data_1525801
_publ_section_title
;
 Hydrothermal synthesis and structure of a novel molybdenum phosphate: Na4
 (H3 O) (Na (H P O4)2 (P O4)4 Mo18 O49) * 16(H2 O)
;
_journal_name_full               'Jiegon Huaxue'
_journal_page_first              447
_journal_page_last               450
_journal_volume                  20
_journal_year                    2001
_chemical_formula_sum            'Mo18 Na5 O40 P6'
_chemical_name_systematic
;
Na4 (H3 O) (Na (H P O4)2 (P O4)4 Mo18 O49) (H2 O)16
;
_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                 108.586
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   14.957
_cell_length_b                   16.535
_cell_length_c                   16.159
_cell_volume                     3787.923
_citation_journal_id_ASTM        JHUADF
_cod_data_source_file            Lin_JHUADF_2001_1498.cif
_cod_data_source_block           Mo18Na5O40P6
_cod_database_code               1525801
Synthesis and structure of double phosphates of titanium and alkali metals
Chudinova, N.; Murashova, E.; Proc. Estonian Acad. Sci. Chem. 49 (2000) 29–35; doi:

data_1525802
_publ_section_title
;
 Synthesis and structure of double phosphates of titanium and alkali
 metals
;
_journal_name_full               'Proc. Estonian Acad. Sci. Chem.'
_journal_page_first              29
_journal_page_last               35
_journal_volume                  49
_journal_year                    2000
_chemical_formula_sum            'Na3 O23 P8 Ti'
_chemical_name_systematic        'Na3 Ti (P8 O23)'
_space_group_IT_number           213
_symmetry_space_group_name_Hall  'P 4bd 2ab 3'
_symmetry_space_group_name_H-M   'P 41 3 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.968
_cell_length_b                   11.968
_cell_length_c                   11.968
_cell_volume                     1714.213
_citation_journal_id_ASTM        PESCFO
_cod_data_source_file            Chudinova_PESCFO_2000_381.cif
_cod_data_source_block           Na3O23P8Ti1
_cod_original_formula_sum        'Na3 O23 P8 Ti1'
_cod_database_code               1525802
Crystallographic and physical properties of new orthorhombic Cu-1212 R (Ba2-x R'x) Cu3 O7+y system (R, R' = La, Pr, Nd; 0.65 < x < 1)
Lin, B.N.; Lin, Y.-H.; Luo, H.M.; Lee, T.-J.; Ho, J.C.; Ku, H.C.; Physica C (Amsterdam) 341 (2000) 407–410; doi:

data_1525803
_publ_section_title
;
 Crystallographic and physical properties of new orthorhombic Cu-1212 R
 (Ba2-x R'x) Cu3 O7+y system (R, R' = La, Pr, Nd; 0.65 < x < 1)
;
_journal_name_full               'Physica C (Amsterdam)'
_journal_page_first              407
_journal_page_last               410
_journal_volume                  341
_journal_year                    2000
_chemical_formula_sum            'Ba1.3 Cu3 La1.7 O7.3'
_chemical_name_systematic        'La (Ba1.3 La0.7) Cu3 O7.3'
_space_group_IT_number           65
_symmetry_space_group_name_Hall  '-C 2 2'
_symmetry_space_group_name_H-M   'C m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.52
_cell_length_b                   5.5252
_cell_length_c                   11.6676
_cell_volume                     355.851
_citation_journal_id_ASTM        PHYCE6
_cod_data_source_file            Lin_PHYCE6_2000_449.cif
_cod_data_source_block           Ba1.3Cu3La1.7O7.3
_cod_original_cell_volume        355.8513
_cod_database_code               1525803
Synthesis and structure of double phosphates of titanium and alkalimetals
Chudinova, N.; Murashova, E.; Proc. Estonian Acad. Sci. Chem. 49 (2000) 29–35; doi:

data_1525804
_publ_section_title
;
 Synthesis and structure of double phosphates of titanium and alkalimetals
;
_journal_name_full               'Proc. Estonian Acad. Sci. Chem.'
_journal_page_first              29
_journal_page_last               35
_journal_volume                  49
_journal_year                    2000
_chemical_formula_sum            'Cs2 O13 P4 Ti'
_chemical_name_systematic        'Cs2 (Ti P4 O13)'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                84.16
_cell_angle_beta                 83.92
_cell_angle_gamma                80.64
_cell_formula_units_Z            2
_cell_length_a                   5.1162
_cell_length_b                   7.9407
_cell_length_c                   15.714
_cell_volume                     624.029
_citation_journal_id_ASTM        PESCFO
_cod_data_source_file            Chudinova_PESCFO_2000_382.cif
_cod_data_source_block           Cs2O13P4Ti1
_cod_original_cell_volume        624.0287
_cod_original_formula_sum        'Cs2 O13 P4 Ti1'
_cod_database_code               1525804
Crystallographic, microstructural and magnetic properties of polycrystalline PrBa~2~Cu~3~O~7-δ~
Lisboa-Filho, P. N.; Zanetti, S. M.; Mombrú, A. W.; Nascente, P. A. P.; Leite, E. R.; Ortiz, W. A.; Araújo-Moreira, F. M.; Superconductor Science and Technology 14 (2001) 522–527; doi:10.1088/0953-2048/14/8/302

data_1525805
_publ_section_title
;
 Crystallographic, microstructural and magnetic properties of
 polycrystalline PrBa~2~Cu~3~O~7-\d~
;
_journal_coden_ASTM              SUSTEF
_journal_issue                   8
_journal_name_full               'Superconductor Science and Technology'
_journal_page_first              522
_journal_page_last               527
_journal_paper_doi               10.1088/0953-2048/14/8/302
_journal_volume                  14
_journal_year                    2001
_chemical_formula_sum            'Ba2 Cu3 O7 Pr'
_chemical_name_systematic        'Pr Ba2 Cu3 O7'
_space_group_IT_number           47
_symmetry_space_group_name_Hall  '-P 2 2'
_symmetry_space_group_name_H-M   'P m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.90574
_cell_length_b                   3.90574
_cell_length_c                   11.80355
_cell_volume                     180.061
_cod_data_source_file            Lisboa-Filho_SUSTEF_2001_1977.cif
_cod_data_source_block           Ba2Cu3O7Pr1
_cod_original_cell_volume        180.0609
_cod_original_formula_sum        'Ba2 Cu3 O7 Pr1'
_cod_database_code               1525805
Tetrahedral-framework structures of (N H4) Li Be F4 and Cs Li Be F4
Chung, S.J.; Hahn, T.; Materials Research Bulletin 7 (1972) 1209–1218; doi:

data_1525806
_publ_section_title
;
 Tetrahedral-framework structures of (N H4) Li Be F4 and Cs Li Be F4
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              1209
_journal_page_last               1218
_journal_volume                  7
_journal_year                    1972
_chemical_formula_sum            'Be F4 H4 Li N'
_chemical_name_systematic        '(N H4) Li Be F4'
_space_group_IT_number           29
_symmetry_space_group_name_Hall  'P 2c -2ac'
_symmetry_space_group_name_H-M   'P c a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.022
_cell_length_b                   5.288
_cell_length_c                   8.623
_cell_volume                     411.389
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Chung_MRBUAC_1972_1950.cif
_cod_data_source_block           H4Be1F4Li1N1
_cod_original_formula_sum        'H4 Be1 F4 Li1 N1'
_cod_database_code               1525806
Crystallographic, microstructural and magnetic properties of polycrystalline PrBa~2~Cu~3~O~7-δ~
Lisboa-Filho, P. N.; Zanetti, S. M.; Mombrú, A. W.; Nascente, P. A. P.; Leite, E. R.; Ortiz, W. A.; Araújo-Moreira, F. M.; Superconductor Science and Technology 14 (2001) 522–527; doi:10.1088/0953-2048/14/8/302

data_1525807
_publ_section_title
;
 Crystallographic, microstructural and magnetic properties of
 polycrystalline PrBa~2~Cu~3~O~7-\d~
;
_journal_coden_ASTM              SUSTEF
_journal_issue                   8
_journal_name_full               'Superconductor Science and Technology'
_journal_page_first              522
_journal_page_last               527
_journal_paper_doi               10.1088/0953-2048/14/8/302
_journal_volume                  14
_journal_year                    2001
_chemical_formula_sum            'Ba Cu1.023 O2.045'
_space_group_IT_number           229
_symmetry_space_group_name_Hall  '-I 4 2 3'
_symmetry_space_group_name_H-M   'I m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            88
_cell_length_a                   18.3742
_cell_length_b                   18.3742
_cell_length_c                   18.3742
_cell_volume                     6203.336
_cod_data_source_file            Lisboa-Filho_SUSTEF_2001_1978.cif
_cod_data_source_block           Ba1Cu1.023O2.045
_cod_original_cell_volume        6203.337
_cod_original_formula_sum        'Ba1 Cu1.023 O2.045'
_cod_database_code               1525807
Tetrahedral-framework structures of (N H4) Li Be F4 and Cs Li Be F4
Chung, S.J.; Hahn, T.; Materials Research Bulletin 7 (1972) 1209–1218; doi:

data_1525808
_publ_section_title
;
 Tetrahedral-framework structures of (N H4) Li Be F4 and Cs Li Be F4
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              1209
_journal_page_last               1218
_journal_volume                  7
_journal_year                    1972
_chemical_formula_sum            'Be Cs F4 Li'
_chemical_name_systematic        'Cs Li (Be F4)'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2n'
_symmetry_space_group_name_H-M   'P 1 1 21/n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                89.75
_cell_formula_units_Z            4
_cell_length_a                   9.306
_cell_length_b                   5.383
_cell_length_c                   8.738
_cell_volume                     437.719
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Chung_MRBUAC_1972_1957.cif
_cod_data_source_block           Be1Cs1F4Li1
_cod_original_cell_volume        437.7189
_cod_original_sg_symbol_Hall     '-P 2ybc (z,x-z,y)'
_cod_original_formula_sum        'Be1 Cs1 F4 Li1'
_cod_database_code               1525808
Hydrothermal synthesis and characterization of two three-dimensional titanium phosphates
Liu, Y.-L.; Shi, Z.; Zhang, L.-R.; Li, B.-Z.; Pang, W.-Q.; Chen, J.-S.; Fu, Y.-L.; Hua, J.; Chemistry of Materials (1,1989-) 13 (2001) 2017–2022; doi:

data_4002316
_publ_section_title
;
 Hydrothermal synthesis and characterization of two three-dimensional
 titanium phosphates
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              2017
_journal_page_last               2022
_journal_volume                  13
_journal_year                    2001
_chemical_formula_sum            'C2 H9 N O16 P4 Ti2'
_chemical_name_systematic        '(Ti2 (H P O4)3 (P O4)) (C4 N2 H12)0.5'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 104.286
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.7455
_cell_length_b                   6.3469
_cell_length_c                   20.48
_cell_volume                     1353.556
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Liu_CMATEX_2001_941.cif
_cod_data_source_block           C2H9N1O16P4Ti2
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'C2 H9 N1 O16 P4 Ti2'
_cod_database_code               4002316