LMucko/crystallography-open-database huggingface dataset:
Effects of Sr substitution for Ba on the crystal structure, oxygen content and electrical properties of Nd (Ba1-x Srx)2 Cu3 O7-d
Wuernisha, T.; Takahashi, Y.; Takase, K.; Sekizawa, K.; Takano, Y.; Journal of Alloys Compd. 377 (2004) 216–220; doi:

data_1532818
_publ_section_title
;
 Effects of Sr substitution for Ba on the crystal structure, oxygen
 content and electrical properties of Nd (Ba1-x Srx)2 Cu3 O7-d
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              216
_journal_page_last               220
_journal_volume                  377
_journal_year                    2004
_chemical_formula_sum            'Ba1.4 Cu3 Nd O6.94 Sr0.6'
_chemical_name_systematic        'Nd Ba1.4 Sr0.6 (Cu3 O6.94)'
_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                   3.8702
_cell_length_b                   3.8856
_cell_length_c                   11.6997
_cell_volume                     175.941
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Wuernisha_JALCEU_2004_1539.cif
_cod_data_source_block           Ba1.4Cu3Nd1O6.94Sr0.6
_cod_original_cell_volume        175.9407
_cod_original_formula_sum        'Ba1.4 Cu3 Nd1 O6.94 Sr0.6'
_cod_database_code               1532818
Intergrown niobian rutile phases with Sc- and W-rich ferrocolumbite: an electron-microprobe and Rietveld study
Okrusch, M.; Schuessler, U.; Hock, R.; Brummer, A.; Theisinger, H.; Baier, M.; American Mineralogist 88 (2003) 986–995; doi:

data_1532819
_publ_section_title
;
 Intergrown niobian rutile phases with Sc- and W-rich ferrocolumbite: an
 electron-microprobe and Rietveld study
;
_journal_name_full               'American Mineralogist'
_journal_page_first              986
_journal_page_last               995
_journal_volume                  88
_journal_year                    2003
_chemical_formula_sum            'O2 Ti'
_chemical_name_systematic        'Ti O2'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.6257
_cell_length_b                   4.6257
_cell_length_c                   2.9806
_cell_volume                     63.776
_citation_journal_id_ASTM        AMMIAY
_cod_data_source_file            Okrusch_AMMIAY_2003_45.cif
_cod_data_source_block           O2Ti1
_cod_original_cell_volume        63.7762
_cod_original_formula_sum        'O2 Ti1'
_cod_database_code               1532819
Synthesis, structure, magnetic properties and XANES spectra of reduced niobate Rb Nax Ca2 Nb3 O10
Byeon Song-Ho; Kim Hee Jin; Kim Dong-Kuk; Hur Nam Hwi; Chemistry of Materials (1,1989-) 15 (2003) 383–389; doi:

data_4002552
_publ_section_title
;
 Synthesis, structure, magnetic properties and XANES spectra of reduced
 niobate Rb Nax Ca2 Nb3 O10
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              383
_journal_page_last               389
_journal_volume                  15
_journal_year                    2003
_chemical_formula_sum            'Ca2 Na0.86 Nb3 O10 Rb'
_chemical_name_systematic        'Rb Na0.86 Ca2 (Nb3 O10)'
_space_group_IT_number           138
_symmetry_space_group_name_Hall  '-P 4ac 2ac'
_symmetry_space_group_name_H-M   'P 42/n c m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.479
_cell_length_b                   5.479
_cell_length_c                   28.8264
_cell_volume                     865.352
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            ByeonSong-Ho_CMATEX_2003_324.cif
_cod_data_source_block           Ca2Na0.86Nb3O10Rb1
_cod_original_cell_volume        865.3525
_cod_original_formula_sum        'Ca2 Na0.86 Nb3 O10 Rb1'
_cod_database_code               4002552
Washing soda (natron), Na2 C O3 * 10(H2 O) revised: crystal structures at low and ambient temperatures
Libowitzky, E.; Giester, G.; Mineralogy and Petrology 77 (2003) 177–195; doi:

data_1532820
_publ_section_title
;
 Washing soda (natron), Na2 C O3 * 10(H2 O) revised: crystal structures at
 low and ambient temperatures
;
_journal_name_full               'Mineralogy and Petrology'
_journal_page_first              177
_journal_page_last               195
_journal_volume                  77
_journal_year                    2003
_chemical_formula_sum            'C H20.24 Na2 O13.12'
_chemical_name_systematic        'Na2 (C O3) (H2 O)10.12'
_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                 115.83
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.75
_cell_length_b                   9.001
_cell_length_c                   12.59
_cell_volume                     1300.508
_citation_journal_id_ASTM        MIPEE9
_cod_data_source_file            Libowitzky_MIPEE9_2003_508.cif
_cod_data_source_block           C1H20.24Na2O13.12
_cod_original_formula_sum        'C1 H20.24 Na2 O13.12'
_cod_database_code               1532820
Effects of Sr substitution for Ba on the crystal structure, oxygen content and electrical properties of Nd (Ba1-x Srx)2 Cu3 O7-d
Wuernisha, T.; Sekizawa, K.; Takahashi, Y.; Takano, Y.; Takase, K.; Journal of Alloys Compd. 377 (2004) 216–220; doi:

data_1532821
_publ_section_title
;
 Effects of Sr substitution for Ba on the crystal structure, oxygen
 content and electrical properties of Nd (Ba1-x Srx)2 Cu3 O7-d
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              216
_journal_page_last               220
_journal_volume                  377
_journal_year                    2004
_chemical_formula_sum            'Ba1.2 Cu3 Nd O6.97 Sr0.8'
_chemical_name_systematic        'Nd Ba1.2 Sr0.8 (Cu3 O6.97)'
_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                   3.869
_cell_length_b                   3.8757
_cell_length_c                   11.6731
_cell_volume                     175.039
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Wuernisha_JALCEU_2004_1540.cif
_cod_data_source_block           Ba1.2Cu3Nd1O6.97Sr0.8
_cod_original_cell_volume        175.0391
_cod_original_formula_sum        'Ba1.2 Cu3 Nd1 O6.97 Sr0.8'
_cod_database_code               1532821
Intergrown niobian rutile phases with Sc- and W-rich ferrocolumbite: an electron-microprobe and Rietveld study
Okrusch, M.; Schuessler, U.; Hock, R.; Theisinger, H.; Baier, M.; Brummer, A.; American Mineralogist 88 (2003) 986–995; doi:

data_1532822
_publ_section_title
;
 Intergrown niobian rutile phases with Sc- and W-rich ferrocolumbite: an
 electron-microprobe and Rietveld study
;
_journal_name_full               'American Mineralogist'
_journal_page_first              986
_journal_page_last               995
_journal_volume                  88
_journal_year                    2003
_chemical_formula_sum            'Nb0.16 O2 Ti0.84'
_chemical_name_systematic        '(Ti0.84 Nb0.16) O2'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.6342
_cell_length_b                   4.6342
_cell_length_c                   2.9886
_cell_volume                     64.183
_citation_journal_id_ASTM        AMMIAY
_cod_data_source_file            Okrusch_AMMIAY_2003_46.cif
_cod_data_source_block           Nb0.16O2Ti0.84
_cod_original_cell_volume        64.18261
_cod_database_code               1532822
V(III) V(IV) (H P O4)4 * enH * (H2 O): a mixed-valence vanadium phosphate with an open framework
Calin, N.; Serre, C.; Sevov, S.C.; Journal of Materials Chemistry 13 (2003) 531–534; doi:

data_7222314
_publ_section_title
;
 V(III) V(IV) (H P O4)4 * enH * (H2 O): a mixed-valence vanadium phosphate
 with an open framework
;
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              531
_journal_page_last               534
_journal_volume                  13
_journal_year                    2003
_chemical_formula_sum            'C2 H15 N2 O17 P4 V2'
_chemical_name_systematic        'V2 ((N H3) C2 H4 (N H2)) (H P O4)4 (H2 O)'
_space_group_IT_number           80
_symmetry_space_group_name_Hall  'I 4bw'
_symmetry_space_group_name_H-M   'I 41'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.3881
_cell_length_b                   6.3881
_cell_length_c                   16.608
_cell_volume                     677.736
_citation_journal_id_ASTM        JMACEP
_cod_data_source_file            Calin_JMACEP_2003_393.cif
_cod_data_source_block           C2H15N2O17P4V2
_cod_original_cell_volume        677.7363
_cod_database_code               7222314
A structural study of ternary lanthanide orthoscandate perovskites
Liferovich, R.P.; Mitchell, R.H.; Journal of Solid State Chemistry 177 (2004) 2188–2197; doi:

data_1532823
_publ_section_title
;
 A structural study of ternary lanthanide orthoscandate perovskites
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              2188
_journal_page_last               2197
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'La O3 Sc'
_chemical_name_systematic        'La (Sc O3)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.6803
_cell_length_b                   5.7907
_cell_length_c                   8.0945
_cell_volume                     266.252
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Liferovich_JSSCBI_2004_1748.cif
_cod_data_source_block           La1O3Sc1
_cod_original_cell_volume        266.2517
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_original_formula_sum        'La1 O3 Sc1'
_cod_database_code               1532823
Single-crystal structure determination of Zr50 Sc12 O118
Wurst, K.; Wallwork, K.S.; Schweda, E.; Bevan, D.J.M.; Mohyla, J.; Hofmann, M.; Solid State Sciences 5 (2003) 1491–1497; doi:

data_1532824
_publ_section_title
;
 Single-crystal structure determination of Zr50 Sc12 O118
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              1491
_journal_page_last               1497
_journal_volume                  5
_journal_year                    2003
_chemical_formula_sum            'O118 Sc12.14 Zr49.86'
_chemical_name_systematic        'Zr49.86 Sc12.14 O118'
_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                   19.7441
_cell_length_b                   19.7441
_cell_length_c                   17.9196
_cell_volume                     6049.697
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Wurst_SSSCFJ_2003_269.cif
_cod_data_source_block           O118Sc12.14Zr49.86
_cod_database_code               1532824
Intergrown niobian rutile phases with Sc- and W-rich ferrocolumbite: an electron-microprobe and Rietveld study
Okrusch, M.; Hock, R.; Schuessler, U.; Brummer, A.; Baier, M.; Theisinger, H.; American Mineralogist 88 (2003) 986–995; doi:

data_1532825
_publ_section_title
;
 Intergrown niobian rutile phases with Sc- and W-rich ferrocolumbite: an
 electron-microprobe and Rietveld study
;
_journal_name_full               'American Mineralogist'
_journal_page_first              986
_journal_page_last               995
_journal_volume                  88
_journal_year                    2003
_chemical_formula_sum            'Nb0.048 O2 Ti0.952'
_chemical_name_systematic        '(Ti0.952 Nb0.048) O2'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.622
_cell_length_b                   4.622
_cell_length_c                   2.9763
_cell_volume                     63.582
_citation_journal_id_ASTM        AMMIAY
_cod_data_source_file            Okrusch_AMMIAY_2003_47.cif
_cod_data_source_block           Nb0.048O2Ti0.952
_cod_original_cell_volume        63.58236
_cod_database_code               1532825
Synthesis and characterization of Li2 Zn Ti3 O8 spinel using the modified polymeric precursor method
Camara, M.S.C.; Gama, L.; Lisboa-Filho, P.N.; Longo, E.; Cabrelon, M.D.; Ortiz, W.A.; Paiva-Santos, C.O.; Leite, E.R.; Materials Chemistry and Physics 82 (2003) 68–72; doi:

data_1532826
_publ_section_title
;
 Synthesis and characterization of Li2 Zn Ti3 O8 spinel using the modified
 polymeric precursor method
;
_journal_name_full               'Materials Chemistry and Physics'
_journal_page_first              68
_journal_page_last               72
_journal_volume                  82
_journal_year                    2003
_chemical_formula_sum            'Li1.96 O8 Ti3 Zn1.04'
_chemical_name_systematic        '(Li0.96 Zn1.04) Li Ti3 O8'
_space_group_IT_number           212
_symmetry_space_group_name_Hall  'P 4acd 2ab 3'
_symmetry_space_group_name_H-M   'P 43 3 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.3738
_cell_length_b                   8.3738
_cell_length_c                   8.3738
_cell_volume                     587.175
_citation_journal_id_ASTM        MCHPDR
_cod_data_source_file            Camara_MCHPDR_2003_485.cif
_cod_data_source_block           Li1.96O8Ti3Zn1.04
_cod_original_cell_volume        587.1753
_cod_database_code               1532826
A structural study of ternary lanthanide orthoscandate perovskites
Liferovich, R.P.; Mitchell, R.H.; Journal of Solid State Chemistry 177 (2004) 2188–2197; doi:

data_1532827
_publ_section_title
;
 A structural study of ternary lanthanide orthoscandate perovskites
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              2188
_journal_page_last               2197
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Nd O3 Sc'
_chemical_name_systematic        'Nd (Sc O3)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.5809
_cell_length_b                   5.7765
_cell_length_c                   8.0072
_cell_volume                     258.137
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Liferovich_JSSCBI_2004_1750.cif
_cod_data_source_block           Nd1O3Sc1
_cod_original_cell_volume        258.1367
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_original_formula_sum        'Nd1 O3 Sc1'
_cod_database_code               1532827
Hydrothermal synthesis and crystal structure of a three-dimensional vanadium tellurite V4 Te4 O18
Xiao Dongrong; Wang Enbo; Wang Shutao; Hou Yuhou; Li Yangguang; Hu Changwen; Xu Lin; Journal of Solid State Chemistry 176 (2003) 159–164; doi:

data_1532828
_publ_section_title
;
 Hydrothermal synthesis and crystal structure of a three-dimensional
 vanadium tellurite V4 Te4 O18
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              159
_journal_page_last               164
_journal_volume                  176
_journal_year                    2003
_chemical_formula_sum            'O18 Te4 V4'
_chemical_name_systematic        'V4 Te4 O18'
_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                 94.45
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.2475
_cell_length_b                   9.4901
_cell_length_c                   10.073
_cell_volume                     690.727
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            XiaoDongrong_JSSCBI_2003_223.cif
_cod_data_source_block           O18Te4V4
_cod_original_cell_volume        690.7274
_cod_database_code               1532828
Intergrown niobian rutile phases with Sc- and W-rich ferrocolumbite: an electron-microprobe and Rietveld study
Okrusch, M.; Brummer, A.; Hock, R.; Schuessler, U.; Baier, M.; Theisinger, H.; American Mineralogist 88 (2003) 986–995; doi:

data_1532829
_publ_section_title
;
 Intergrown niobian rutile phases with Sc- and W-rich ferrocolumbite: an
 electron-microprobe and Rietveld study
;
_journal_name_full               'American Mineralogist'
_journal_page_first              986
_journal_page_last               995
_journal_volume                  88
_journal_year                    2003
_chemical_formula_sum
'Fe0.794 Mn0.067 Nb1.578 O6 Sc0.047 Sn0.015 Ta0.078 Ti0.335 W0.044'
_chemical_name_systematic
;
(Nb1.578 Sn0.015 Ta0.078 W0.044 Sc0.047 Ti0.335 Mn0.067 Fe0.794) O6
;
_space_group_IT_number           60
_symmetry_space_group_name_Hall  '-P 2n 2ab'
_symmetry_space_group_name_H-M   'P b c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   14.174
_cell_length_b                   5.692
_cell_length_c                   5.065
_cell_volume                     408.636
_citation_journal_id_ASTM        AMMIAY
_cod_data_source_file            Okrusch_AMMIAY_2003_48.cif
_cod_data_source_block
Fe0.794Mn0.067Nb1.578O6Sc0.047Sn0.015Ta0.078Ti0.335W0.044
_cod_original_cell_volume        408.6361
_cod_original_formula_sum
;
Fe0.794 Mn0.067 Nb1.578 O6 Sc0.047 Sn0.015 Ta0.078 Ti0.335 W0.044
;
_cod_database_code               1532829
The Re Os4 (mue-H) (C O)n (n= 19, 18, 16) clusters
Canal, J.P.; Yap, G.P.A.; Pomeroy, R.K.; Organometallics 22 (2003) 3439–3447; doi:

data_4086239
_publ_section_title
;
 The Re Os4 (mue-H) (C O)n (n= 19, 18, 16) clusters
;
_journal_name_full               Organometallics
_journal_page_first              3439
_journal_page_last               3447
_journal_volume                  22
_journal_year                    2003
_chemical_formula_sum            'C19 H O19 Os4 Re'
_chemical_name_systematic
;
(H ((C O)4 Os)2 ((C O)3 Os) ((Re (C O)5) Os (C O)3))
;
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                72.652
_cell_angle_beta                 67.689
_cell_angle_gamma                87.151
_cell_formula_units_Z            4
_cell_length_a                   12.762
_cell_length_b                   15.661
_cell_length_c                   16.031
_cell_volume                     2822.022
_citation_journal_id_ASTM        ORGND7
_cod_data_source_file            Canal_ORGND7_2003_869.cif
_cod_data_source_block           C19H1O19Os4Re1
_cod_original_formula_sum        'C19 H1 O19 Os4 Re1'
_cod_database_code               4086239
A structural study of ternary lanthanide orthoscandate perovskites
Liferovich, R.P.; Mitchell, R.H.; Journal of Solid State Chemistry 177 (2004) 2188–2197; doi:

data_1532830
_publ_section_title
;
 A structural study of ternary lanthanide orthoscandate perovskites
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              2188
_journal_page_last               2197
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'O3 Sc Sm'
_chemical_name_systematic        'Sm (Sc O3)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.5343
_cell_length_b                   5.7622
_cell_length_c                   7.9674
_cell_volume                     254.078
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Liferovich_JSSCBI_2004_1751.cif
_cod_data_source_block           O3Sc1Sm1
_cod_original_cell_volume        254.0783
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_original_formula_sum        'O3 Sc1 Sm1'
_cod_database_code               1532830
Hydrothermal synthesis and characterization of an open framework zincophosphate with Zn4 O4 tetrameric clusters
Xing Yan; Fu Yunlong; Shi Zhan; Hua Jia; Zhang Ping; Cui Yanjie; Pang Wenqin; Gaodeng Xuexiao Huaxue Xuebao 24 (2003) 377–380; doi:

data_1532831
_publ_section_title
;
 Hydrothermal synthesis and characterization of an open framework
 zincophosphate with Zn4 O4 tetrameric clusters
;
_journal_name_full               'Gaodeng Xuexiao Huaxue Xuebao'
_journal_page_first              377
_journal_page_last               380
_journal_volume                  24
_journal_year                    2003
_chemical_formula_sum            'C4 H14 N2 O16 P4 Zn5'
_chemical_name_systematic        'Zn5 (N H3 (C H2)4 N H3) (P O4)4'
_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                   18.344
_cell_length_b                   13.3034
_cell_length_c                   7.4497
_cell_volume                     1818.007
_citation_journal_id_ASTM        KTHPDM
_cod_data_source_file            XingYan_KTHPDM_2003_478.cif
_cod_data_source_block           C4H14N2O16P4Zn5
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