LMucko/crystallography-open-database huggingface dataset:
The heteropolymolybdate family: structural relations, nomenclature scheme and new species
Kampf, A. R.; Mills, S. J.; Rumsey, M. S.; Dini, M.; Birch, W. D.; Spratt, J.; Pluth, J. J.; Steele, I. M.; Jenkins, R. A.; Pinch, W. W.; Mineralogical Magazine 76 (2012) 1175–1207; doi:10.1180/minmag.2012.076.5.09

data_9015854
_publ_section_title
;
 The heteropolymolybdate family: structural relations, nomenclature scheme and new species
;
_journal_name_full               'Mineralogical Magazine'
_journal_page_first              1175
_journal_page_last               1207
_journal_paper_doi               10.1180/minmag.2012.076.5.09
_journal_volume                  76
_journal_year                    2012
_chemical_compound_source        'Chuquicamata mine, Antofagasta, Chile'
_chemical_formula_sum            'As2 Fe3 H27.12 Mo8 Na3.52 O50.56'
_chemical_name_mineral           Obradovicite-NaNa
_space_group_IT_number           53
_symmetry_space_group_name_Hall  '-P 2bc 2bc'
_symmetry_space_group_name_H-M   'P n m b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   14.8866
_cell_length_b                   11.0880
_cell_length_c                   15.0560
_cell_volume                     2485.183
_database_code_amcsd             0019592
_exptl_crystal_density_diffrn    2.675
_cod_original_formula_sum        'Na3.52 Mo8 Fe3 As2 O50.56 H27.12'
_cod_database_code               9015854
Systemes magnetiques de basse dimensionnalite dans des fluorures de type usovite et jarlite _cod_database_code 1008571
le Lirzin, A.; Soubeyroux, J.; Tressaud, A.; Georges, R.; Darriet, J.; Journal de Chimie Physique et de Physico-Chimie Biologique 88 (1991) 2173–2189; doi:

data_9015855
_publ_section_title
;
 Systemes magnetiques de basse dimensionnalite dans des fluorures de
 type usovite et jarlite
 _cod_database_code 1008571
;
_journal_name_full
'Journal de Chimie Physique et de Physico-Chimie Biologique'
_journal_page_first              2173
_journal_page_last               2189
_journal_volume                  88
_journal_year                    1991
_chemical_formula_sum            'Al Ba Co0.5 F7 Mn0.5'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 91.08
_cell_angle_gamma                90
_cell_length_a                   13.658
_cell_length_b                   5.205
_cell_length_c                   14.380
_cell_formula_units_Z            8
_cell_volume                     1022.091
_database_code_amcsd             0016462
_exptl_crystal_density_diffrn    4.604
_cod_duplicate_entry             1008571
_cod_original_formula_sum        'Ba (Mn.5 Co.5) Al F7'
_cod_database_code               9015855
_amcsd_formula_title             'Al2 Ba2 Co F14 Mn'
Synthese et structure cristalline du dihydrogenodiphosphate de rubidium hemihydrate: Rb2H2P2O7 . 1/2H2O _cod_database_code 1007212
Averbuch-Pouchot M; Durif, A.; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 316 (1993) 469–476; doi:

data_9015856
_publ_section_title
;
 Synthese et structure cristalline du dihydrogenodiphosphate de rubidium
 hemihydrate: Rb2H2P2O7 . 1/2H2O
 _cod_database_code 1007212
;
_journal_name_full
'Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences'
_journal_page_first              469
_journal_page_last               476
_journal_volume                  316
_journal_year                    1993
_chemical_formula_sum            'H O3.75 P Rb'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2n'
_symmetry_space_group_name_H-M   'P n a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   19.568
_cell_length_b                   10.545
_cell_length_c                   7.773
_cell_formula_units_Z            16
_cell_volume                     1603.916
_database_code_amcsd             0012310
_exptl_crystal_density_diffrn    2.939
_cod_duplicate_entry             1007212
_cod_original_formula_sum        'Rb P O3.75 H'
_cod_database_code               9015856
_amcsd_formula_title             'H3 O7.5 P2 Rb2'
Red micas from basal ignimbrites of Mt. Vulture (Italy): interlayer content appraisal by a multi-methodic approach Note: Sample LC6_R7
Scordari, F.; Schingaro, E.; Ventruti, G.; Lacalamita, M.; Ottolini, L.; Physics and Chemistry of Minerals 35 (2008) 163–174; doi:10.1007/s00269-007-0208-0

data_9015857
_publ_section_title
;
 Red micas from basal ignimbrites of Mt. Vulture (Italy): interlayer content
 appraisal by a multi-methodic approach
 Note: Sample LC6_R7
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              163
_journal_page_last               174
_journal_paper_doi               10.1007/s00269-007-0208-0
_journal_volume                  35
_journal_year                    2008
_chemical_compound_source        'Mt. Vulture, Italy'
_chemical_formula_sum            'Fe0.765 H1.59 K Mg2.235 O12 Si4'
_chemical_name_mineral           Phlogopite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 99.983
_cell_angle_gamma                90
_cell_length_a                   5.3416
_cell_length_b                   9.2411
_cell_length_c                   10.2332
_cell_formula_units_Z            2
_cell_volume                     497.486
_database_code_amcsd             0018308
_exptl_crystal_density_diffrn    2.951
_cod_original_formula_sum        'K (Mg2.235 Fe.765) Si4 O12 H1.59'
_cod_database_code               9015857
High-temperature structural behaviors of anhydrous wadsleyite and forsterite Note: T = 297 K
Trots, D. M.; Kurnosov, A.; Ballaran, T. F.; Frost, D. J.; American Mineralogist 97 (2012) 1582–1590; doi:10.2138/am.2012.3992

data_9015858
_publ_section_title
;
 High-temperature structural behaviors of anhydrous wadsleyite and forsterite
 Note: T = 297 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1582
_journal_page_last               1590
_journal_paper_doi               10.2138/am.2012.3992
_journal_volume                  97
_journal_year                    2012
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Wadsleyite
_space_group_IT_number           74
_symmetry_space_group_name_Hall  '-I 2b 2'
_symmetry_space_group_name_H-M   'I m m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.7016
_cell_length_b                   11.4427
_cell_length_c                   8.2491
_cell_formula_units_Z            8
_cell_volume                     538.185
_database_code_amcsd             0019743
_exptl_crystal_density_diffrn    3.473
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9015858
Cation ordering in Pb2±bearing, Mn3±rich pargasite from Langban, Sweden
Halenius, U.; Bosi, F.; American Mineralogist 97 (2012) 1635–1640; doi:10.2138/am.2012.4137

data_9015859
_publ_section_title
;
 Cation ordering in Pb2+-bearing, Mn3+-rich pargasite from Langban, Sweden
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1635
_journal_page_last               1640
_journal_paper_doi               10.2138/am.2012.4137
_journal_volume                  97
_journal_year                    2012
_chemical_compound_source        'Langban, Sweden'
_chemical_formula_sum
'Al1.898 Ca1.93 Fe0.05 H2 K0.06 Mg4.24 Mn0.57 Na1.8 O24 Pb0.134 Si6.372'
_chemical_name_mineral           Pargasite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 105.445
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.9448
_cell_length_b                   18.0171
_cell_length_c                   5.2829
_cell_volume                     912.387
_database_code_amcsd             0019530
_exptl_crystal_density_diffrn    3.284
_cod_original_formula_sum
'Na1.8 Pb.134 K.06 Mg4.24 Mn.57 Fe.05 Al1.898 Ca1.93 Si6.372 O24 H2'
_cod_database_code               9015859
Etude cristallographique de nouvaux seleniures des terres rares et de sodium _cod_database_code 1009042
Ballestracci, R.; Bertaut, E.; Bulletin de la Societe Francaise de Mineralogie et de Cristallographie 88 (1965) 136–138; doi:

data_9015860
_publ_section_title
;
 Etude cristallographique de nouvaux seleniures des terres rares et de sodium
 _cod_database_code 1009042
;
_journal_name_full
'Bulletin de la Societe Francaise de Mineralogie et de Cristallographie'
_journal_page_first              136
_journal_page_last               138
_journal_volume                  88
_journal_year                    1965
_chemical_formula_sum            'La0.5 Na0.5 Se'
_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_length_a                   6.105
_cell_length_b                   6.105
_cell_length_c                   6.105
_cell_formula_units_Z            4
_cell_volume                     227.540
_database_code_amcsd             0016903
_exptl_crystal_density_diffrn    4.668
_cod_duplicate_entry             1009042
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        '(Na.5 La.5) Se'
_cod_database_code               9015860
_amcsd_formula_title             'La Na Se2'
Kinetics of Fe-oxidation/deprotonation process in Fe-rich phlogopite under isothermal conditions Sample: SA1_14n
Zema, M.; Ventruti, G.; Lacalamita, M.; Scordari, F.; American Mineralogist 95 (2010) 1458–1466; doi:10.2138/am.2010.3523

data_9015861
_publ_section_title
;
 Kinetics of Fe-oxidation/deprotonation process in Fe-rich phlogopite
 under isothermal conditions
 Sample: SA1_14n
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1458
_journal_page_last               1466
_journal_paper_doi               10.2138/am.2010.3523
_journal_volume                  95
_journal_year                    2010
_chemical_compound_source        'Mt. Vulture, Potenza, Italy'
_chemical_formula_sum
'Al1.33 Ba0.05 F0.17 Fe0.807 H1.553 K0.83 Mg2.193 Na0.07 O11.83 Si2.67'
_chemical_name_mineral           Phlogopite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.017
_cell_angle_gamma                90
_cell_length_a                   5.3403
_cell_length_b                   9.2481
_cell_length_c                   10.2327
_cell_formula_units_Z            2
_cell_volume                     497.665
_database_code_amcsd             0017714
_exptl_crystal_density_diffrn    2.965
_cod_original_formula_sum
'K.83 Na.07 Ba.05 (Mg2.193 Fe.807) (Si2.67 Al1.33) O11.83 F.17 H1.553'
_cod_database_code               9015861
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 0.0001 GPa
Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.; Physics and Chemistry of Minerals 35 (2008) 493–504; doi:10.1007/s00269-008-0244-4

data_9015862
_publ_section_title
;
 The effect of oxygen vacancies and aluminium substitution on the
 high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5
 Note: x = 0.37
 Note: P = 0.0001 GPa
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              493
_journal_page_last               504
_journal_paper_doi               10.1007/s00269-008-0244-4
_journal_volume                  35
_journal_year                    2008
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Al0.37 Ca2 Fe1.63 O5'
_chemical_name_mineral           Brownmillerite
_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_length_a                   5.4042
_cell_length_b                   14.6835
_cell_length_c                   5.5947
_cell_formula_units_Z            4
_cell_volume                     443.954
_database_code_amcsd             0017766
_exptl_crystal_density_diffrn    3.907
_cod_original_formula_sum        'Ca2 (Fe1.63 Al.37) O5'
_cod_database_code               9015862
Redetermined crystal structures of PdAs2, PdSb2, PtP2, PtAs2, PtSb2, alpha-PtBi2, and AuSb2
Furuseth, S.; Selte, K.; Kjekshus, A.; Acta Chemica Scandinavica 19 (1965) 735–741; doi:10.3891/acta.chem.scand.19-0735

data_9015863
_publ_section_title
;
 Redetermined crystal structures of PdAs2, PdSb2,
 PtP2, PtAs2, PtSb2, alpha-PtBi2, and AuSb2
;
_journal_name_full               'Acta Chemica Scandinavica'
_journal_page_first              735
_journal_page_last               741
_journal_paper_doi               10.3891/acta.chem.scand.19-0735
_journal_volume                  19
_journal_year                    1965
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Pd Sb2'
_space_group_IT_number           205
_symmetry_space_group_name_Hall  '-P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P a -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   6.4584
_cell_length_b                   6.4584
_cell_length_c                   6.4584
_cell_formula_units_Z            4
_cell_volume                     269.386
_database_code_amcsd             0017784
_exptl_crystal_density_diffrn    8.628
_cod_original_sg_symbol_H-M      'P a 3'
_cod_database_code               9015863
_amcsd_formula_title             PdSb2
Pb1-xSr4Fe2O9-d: a layered iron oxide intergrowth of 1201- and 0201-type structures _cod_database_code 1001559
Lucas, S.; Groult, D.; Nguyen, N.; Michel, C.; Hervieu, M.; Raveau, B.; Journal of Solid State Chemistry 102 (1993) 20–30; doi:10.1006/jssc.1993.1004

data_9015864
_publ_section_title
;
 Pb1-xSr4Fe2O9-d: a layered iron oxide intergrowth of 1201- and
 0201-type structures
 _cod_database_code 1001559
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              20
_journal_page_last               30
_journal_paper_doi               10.1006/jssc.1993.1004
_journal_volume                  102
_journal_year                    1993
_chemical_formula_sum            'Fe2 O9 Pb0.785 Sr4'
_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_length_a                   3.8349
_cell_length_b                   3.8349
_cell_length_c                   30.664
_cell_formula_units_Z            2
_cell_volume                     450.959
_database_code_amcsd             0013759
_exptl_crystal_density_diffrn    5.662
_cod_duplicate_entry             1001559
_cod_original_formula_sum        'Pb.785 Sr4 Fe2 O9'
_cod_database_code               9015864
_amcsd_formula_title             'Fe2 O9 Pb0.78 Sr4'
Crystal structure of silver phosphate and silver arsenate (Ag3 X O4) _cod_database_code 1010605
Wyckoff, R.; American Journal of Science 10 (1925) 107–118; doi:

data_9015865
_publ_section_title
;
 Crystal structure of silver phosphate and silver arsenate (Ag3 X O4)
 _cod_database_code 1010605
;
_journal_name_full               'American Journal of Science'
_journal_page_first              107
_journal_page_last               118
_journal_volume                  10
_journal_year                    1925
_chemical_formula_sum            'Ag3 P'
_space_group_IT_number           218
_symmetry_space_group_name_Hall  'P -4n 2 3'
_symmetry_space_group_name_H-M   'P -4 3 n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   6.
_cell_length_b                   6.
_cell_length_c                   6.
_cell_formula_units_Z            2
_cell_volume                     216.000
_database_code_amcsd             0017488
_exptl_crystal_density_diffrn    5.452
_cod_duplicate_entry             1010605
_cod_database_code               9015865
_amcsd_formula_title             'Ag3 O4 P'
Position of cations and water molecules in hydrated chabazite. Natural and Na-, Ca-, Sr- and K-exchanged chabazites Note: K-exchanged
Alberti, A.; Galli, E.; Vezzalini, G.; Passaglia, E.; Zanazzi, P. F.; Zeolites 2 (1982) 303–309; doi:10.1016/S0144-2449(82)80075-4

data_9015866
_publ_section_title
;
 Position of cations and water molecules in hydrated chabazite.
 Natural and Na-, Ca-, Sr- and K-exchanged chabazites
 Note: K-exchanged
;
_journal_name_full               Zeolites
_journal_page_first              303
_journal_page_last               309
_journal_paper_doi               10.1016/S0144-2449(82)80075-4
_journal_volume                  2
_journal_year                    1982
_chemical_compound_source        'Keller, Nidda, Germany'
_chemical_formula_sum            'Al3.6 H20.04 K3.02 Na0.44 O34.02 Si8.4'
_chemical_name_mineral           Chabazite-K
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-P 3* 2'
_symmetry_space_group_name_H-M   'R -3 m :R'
_cell_angle_alpha                94.29
_cell_angle_beta                 94.29
_cell_angle_gamma                94.29
_cell_formula_units_Z            1
_cell_length_a                   9.442
_cell_length_b                   9.442
_cell_length_c                   9.442
_cell_volume                     834.316
_database_code_amcsd             0017688
_exptl_crystal_density_diffrn    2.042
_cod_original_cell_volume        834.317
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Na.44 K3.02 (Al3.6 Si8.4) O34.02 H20.04'
_cod_database_code               9015866
Etude de la structure cristalline du sulfite de magnesium hexahydrate, Mg S O3 (H2 O)6
Flack, H.; Acta Crystallographica, Section B 29 (1973) 656–658; doi:10.1107/S0567740873003110

data_9015867
_publ_section_title
;
 Etude de la structure cristalline du sulfite de magnesium hexahydrate,
 Mg S O3 (H2 O)6
;
_journal_issue                   4
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              656
_journal_page_last               658
_journal_paper_doi               10.1107/S0567740873003110
_journal_volume                  29
_journal_year                    1973
_chemical_formula_sum            'Mg O9 S'
_space_group_IT_number           146
_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_length_a                   8.830
_cell_length_b                   8.830
_cell_length_c                   9.075
_cell_formula_units_Z            3
_cell_volume                     612.772
_database_code_amcsd             0018267
_exptl_crystal_density_diffrn    1.629
_cod_duplicate_entry             1100103
_cod_original_sg_symbol_H-M      'R 3'
_cod_original_formula_sum        'Mg S O9'
_cod_database_code               9015867
_amcsd_formula_title             'H12 Mg O9 S'
Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study Note: T = 280 K
Rinaldi, R.; Gatta, G. D.; Angel, R. J.; American Mineralogist 95 (2010) 1413–1421; doi:10.2138/am.2010.3536

data_9015868
_publ_section_title
;
 Crystal chemistry and low-temperature behavior of datolite:
 a single-crystal X-ray diffraction study
 Note: T = 280 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1413
_journal_page_last               1421
_journal_paper_doi               10.2138/am.2010.3536
_journal_volume                  95
_journal_year                    2010
_chemical_compound_source        'Valmozzola, Parma, Italy'
_chemical_formula_sum            'B Ca H O5 Si'
_chemical_name_mineral           Datolite
_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                 90.159
_cell_angle_gamma                90
_cell_length_a                   4.8355
_cell_length_b                   7.6085
_cell_length_c                   9.6326
_cell_formula_units_Z            4
_cell_volume                     354.391
_database_code_amcsd             0017705
_exptl_crystal_density_diffrn    2.998
_cod_original_formula_sum        'Ca B Si O5 H'
_cod_database_code               9015868
Lead-tellurium oxysalts from Otto Mountain near Baker, California: VII. Chromschieffelinite, Pb10Te6O20(OH)14(CrO4)(H2O)5, the chromate analog of schieffelinite
Kampf, A. R.; Mills, S. J.; Housley, R. M.; Rumsey, M. S.; Spratt, J.; American Mineralogist 97 (2012) 212–219; doi:10.2138/am.2011.3909

data_9015869
_publ_section_title
;
 Lead-tellurium oxysalts from Otto Mountain near Baker, California:
 VII. Chromschieffelinite, Pb10Te6O20(OH)14(CrO4)(H2O)5,
 the chromate analog of schieffelinite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              212
_journal_page_last               219
_journal_paper_doi               10.2138/am.2011.3909
_journal_volume                  97
_journal_year                    2012
_chemical_compound_source        'Otto Mountain near Baker, California, USA'
_chemical_formula_sum            'Cr0.5 H12 O21.5 Pb5 Te3'
_chemical_name_mineral           Chromschieffelinite
_space_group_IT_number           20
_symmetry_space_group_name_Hall  'C 2c 2'
_symmetry_space_group_name_H-M   'C 2 2 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.6646
_cell_length_b                   19.4962
_cell_length_c                   10.5101
_cell_volume                     1980.344
_database_code_amcsd             0018766
_exptl_crystal_density_diffrn    6.040
_cod_original_cell_volume        1980.345
_cod_original_formula_sum        'Pb5 Te3 Cr.5 O21.5 H12'
_cod_database_code               9015869
Electronic structure and magnetic properties of monoclinic beta-Cu2V2O7: A GGA+U study Note: theoretical study, in a triclinic setting
Yashima, M.; Suzuki, R. O.; Physical Review B 79 (2009) 125201–125206; doi:10.1103/PhysRevB.79.125201

data_9015870
_publ_section_title
;
 Electronic structure and magnetic properties of monoclinic beta-Cu2V2O7:
 A GGA+U study
 Note: theoretical study, in a triclinic setting
;
_journal_name_full               'Physical Review B'
_journal_page_first              125201
_journal_page_last               125206
_journal_paper_doi               10.1103/PhysRevB.79.125201
_journal_volume                  79
_journal_year                    2009
_chemical_formula_sum            'Cu2 O7 V2'
_chemical_name_mineral           Ziesite
_space_group_IT_number           1
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                103.61
_cell_angle_beta                 109.71
_cell_angle_gamma                45.74
_cell_length_a                   7.8468
_cell_length_b                   5.6213
_cell_length_c                   10.18
_cell_formula_units_Z            2
_cell_volume                     302.746
_database_code_amcsd             0018361
_exptl_crystal_density_diffrn    3.740
_cod_original_formula_sum        'Cu2 V2 O7'
_cod_database_code               9015870