LMucko/crystallography-open-database huggingface dataset:
The disordered Spinel Na Ag Mo O~4~ and Its High Temperature, Ordered Orthorhombic Polymorph
Rulmont, A; Tarte, P; Foumakoye, G; Fransolet, A M; Choisnet, J; Journal of Solid State Chemistry 76 (1988) 18–25; doi:10.1016/0022-4596(88)90188-0

data_1001372
_publ_section_title
;
The disordered Spinel Na Ag Mo O~4~ and Its High Temperature, Ordered
Orthorhombic Polymorph
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              18
_journal_page_last               25
_journal_paper_doi               10.1016/0022-4596(88)90188-0
_journal_volume                  76
_journal_year                    1988
_chemical_formula_structural     'Na Ag Mo O4'
_chemical_formula_sum            'Ag Mo Na O4'
_chemical_name_systematic        'Sodium silver molybenum oxide -II'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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                   10.384(1)
_cell_length_b                   7.1220(8)
_cell_length_c                   5.5933(6)
_cell_volume                     413.7
_refine_ls_R_factor_all          0.079
_cod_database_code               1001372
Tl Ba~2-x~ Ca~2+x~ Cu~3~ O~10-y~ : un supraconducteur a 120 K, nouveau terme d'une grande famille d'intercroissances de couches multiples types chlorure de sodium et de couches multiples de type perovskite deficitaires en oxygene
Martin, C; Michel, C; Maignan, A; Hervieu, M; Raveau, B; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 307 (1988) 27–32; doi:

data_1001373
_publ_section_title
;
Tl Ba~2-x~ Ca~2+x~ Cu~3~ O~10-y~ : un supraconducteur a 120 K, nouveau
terme d'une grande famille d'intercroissances de couches multiples
types chlorure de sodium et de couches multiples de type perovskite
deficitaires en oxygene
;
_journal_coden_ASTM              CHDCAQ
_journal_name_full
;
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences,
Serie C, Sciences Chimiques (1966-)
;
_journal_page_first              27
_journal_page_last               32
_journal_volume                  307
_journal_year                    1988
_chemical_formula_structural     'Tl0.93 Ba2 Ca2 Cu3 O8.84'
_chemical_formula_sum            'Ba2 Ca2 Cu3 O8.84 Tl0.93'
_chemical_name_systematic
;
Barium calcium copper(II,III) thallium oxide (2/2/4/.93/8.84)
;
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.844
_cell_length_b                   3.844
_cell_length_c                   15.88
_cell_volume                     234.6
_refine_ls_R_factor_all          0.08
_cod_original_formula_sum        'Ba2 Ca2 Cu3 O8.84 Tl.93'
_cod_database_code               1001373
Les pyrophosphates A(II)~x~ M P~2~ O~7~: Synthese et etude structurale de Ba Co P~2~ O~7~ et Ba Ni P~2~ O~7~
Riou, D; Labbe, P; Goreaud, M; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 307 (1988) 1751–1756; doi:

data_1001374
_publ_section_title
;
Les pyrophosphates A(II)~x~ M P~2~ O~7~: Synthese et etude structurale
de Ba Co P~2~ O~7~ et Ba Ni P~2~ O~7~
;
_journal_coden_ASTM              CHDCAQ
_journal_name_full
;
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences,
Serie C, Sciences Chimiques (1966-)
;
_journal_page_first              1751
_journal_page_last               1756
_journal_volume                  307
_journal_year                    1988
_chemical_formula_structural     'Ca Co P2 O7'
_chemical_formula_sum            'Ca Co O7 P2'
_chemical_name_systematic        'Calcium cobalt diphosphate'
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                66.407(6)
_cell_angle_beta                 83.264(5)
_cell_angle_gamma                87.579(6)
_cell_formula_units_Z            2
_cell_length_a                   6.5476(3)
_cell_length_b                   6.5441(6)
_cell_length_c                   6.5743(5)
_cell_volume                     256.4
_refine_ls_R_factor_all          0.029
_cod_database_code               1001374
Les pyrophosphates A(II)~x~ M P~2~ O~7~: Synthese et etude structurale de Ba Co P~2~ O~7~ et Ba Ni P~2~ O~7~
Riou, D; Labbe, P; Goreaud, M; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 307 (1988) 903–907; doi:

data_1001375
_publ_section_title
;
Les pyrophosphates A(II)~x~ M P~2~ O~7~: Synthese et etude structurale
de Ba Co P~2~ O~7~ et Ba Ni P~2~ O~7~
;
_journal_coden_ASTM              CHDCAQ
_journal_name_full
;
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences,
Serie C, Sciences Chimiques (1966-)
;
_journal_page_first              903
_journal_page_last               907
_journal_volume                  307
_journal_year                    1988
_chemical_formula_structural     'Ba Co P2 O7'
_chemical_formula_sum            'Ba Co O7 P2'
_chemical_name_systematic        'Barium cobalt diphosphate'
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                101.217(4)
_cell_angle_beta                 84.191(8)
_cell_angle_gamma                89.319(8)
_cell_formula_units_Z            2
_cell_length_a                   5.3230(6)
_cell_length_b                   7.5799(4)
_cell_length_c                   7.1174(3)
_cell_volume                     280.1
_refine_ls_R_factor_all          0.04
_cod_database_code               1001375
La~3~ Ba~3~ Cu~6~ O~14+x~: A Single Phase Or A Mixture?
Domenges, B; Hervieu, M; Michel, C; Maignan, A; Raveau, B; Physica Status Solidi, Sectio A: Applied Research 107 (1988) 73–84; doi:10.1002/pssa.2211070106

data_1001376
_publ_section_title
;
La~3~ Ba~3~ Cu~6~ O~14+x~: A Single Phase Or A Mixture?
;
_journal_coden_ASTM              PSSABA
_journal_name_full
;
Physica Status Solidi, Sectio A: Applied Research
;
_journal_page_first              73
_journal_page_last               84
_journal_paper_doi               10.1002/pssa.2211070106
_journal_volume                  107
_journal_year                    1988
_chemical_formula_structural     'La1.5 Ba1.5 Cu3 O7.02'
_chemical_formula_sum            'Ba1.5 Cu3 La1.5 O7.02'
_chemical_name_systematic
;
Lanthanum barium copper oxide (1.5/1.5/3/7.02)
;
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.9098(1)
_cell_length_b                   3.9098(1)
_cell_length_c                   11.7058(5)
_cell_volume                     178.9
_refine_ls_R_factor_all          0.024
_cod_database_code               1001376
Crystallographic study of the tetragonal high-T~c~ superconductor Y Ba~2~ (Cu~.95~ Fe~.05~)~3~ O~7~
Roth, G; Heger, G; Renker, B; Pannetier, J; Caignaert, V; Hervieu, M; Raveau, B; Physica C (Amsterdam) (152,1988-) 153 (1988) 972–973; doi:

data_1001377
_publ_section_title
;
Crystallographic study of the tetragonal high-T~c~ superconductor Y
Ba~2~ (Cu~.95~ Fe~.05~)~3~ O~7~
;
_journal_coden_ASTM              PHYCE6
_journal_name_full               'Physica C (Amsterdam) (152,1988-)'
_journal_page_first              972
_journal_page_last               973
_journal_volume                  153
_journal_year                    1988
_chemical_formula_analytical     'Y Ba2 (Fe.05 Cu.95)3 O7'
_chemical_formula_structural     'Y Ba2 Cu2.98 O6.92'
_chemical_formula_sum            'Ba2 Cu2.98 O6.92 Y'
_chemical_name_systematic        'Yttrium barium copper oxide (1/2/3/6.9)'
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.863(1)
_cell_length_b                   3.863(1)
_cell_length_c                   11.626(3)
_cell_volume                     173.5
_refine_ls_R_factor_all          0.036
_cod_database_code               1001377
Crystallographic study of the tetragonal high-T~c~ superconductor Y Ba~2~ (Cu~.95~ Fe~.05~)~3~ O~7~
Roth, G; Heger, G; Renker, B; Pannetier, J; Caignaert, V; Hervieu, M; Raveau, B; Physica C (Amsterdam) (152,1988-) 153 (1988) 972–973; doi:

data_1001378
_publ_section_title
;
Crystallographic study of the tetragonal high-T~c~ superconductor Y
Ba~2~ (Cu~.95~ Fe~.05~)~3~ O~7~
;
_journal_coden_ASTM              PHYCE6
_journal_name_full               'Physica C (Amsterdam) (152,1988-)'
_journal_page_first              972
_journal_page_last               973
_journal_volume                  153
_journal_year                    1988
_chemical_formula_analytical     'Y Ba2 (Fe.05 Cu.95)3 O7'
_chemical_formula_structural     'Y Ba2 Cu2.98 O6.96'
_chemical_formula_sum            'Ba2 Cu2.98 O6.96 Y'
_chemical_name_systematic        'Yttrium barium copper oxide (1/2/3/7)'
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.858(1)
_cell_length_b                   3.858(1)
_cell_length_c                   11.585(3)
_cell_volume                     172.4
_refine_ls_R_factor_all          0.033
_cod_database_code               1001378
Crystallographic study of the tetragonal high-T~c~ superconductor Y Ba~2~ (Cu~.95~ Fe~.05~)~3~ O~7~
Roth, G; Heger, G; Renker, B; Pannetier, J; Caignaert, V; Hervieu, M; Raveau, B; Physica C (Amsterdam) (152,1988-) 153 (1988) 972–973; doi:

data_1001379
_publ_section_title
;
Crystallographic study of the tetragonal high-T~c~ superconductor Y
Ba~2~ (Cu~.95~ Fe~.05~)~3~ O~7~
;
_journal_coden_ASTM              PHYCE6
_journal_name_full               'Physica C (Amsterdam) (152,1988-)'
_journal_page_first              972
_journal_page_last               973
_journal_volume                  153
_journal_year                    1988
_chemical_formula_analytical     'Y Ba2 (Fe.05 Cu.95)3 O7'
_chemical_formula_structural     'Y Ba2 Cu2.93 O7'
_chemical_formula_sum            'Ba2 Cu2.93 O7 Y'
_chemical_name_systematic        'Yttrium barium copper oxide (1/2/2.9/7)'
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.862(1)
_cell_length_b                   3.862(1)
_cell_length_c                   11.673(3)
_cell_volume                     174.1
_refine_ls_R_factor_all          0.023
_cod_database_code               1001379
A novel form of molybdenum(V) phosphate: δ-KMo~2~P~3~O~13~
Leclaire, A.; Borel, M. M.; Grandin, A.; Raveau, B.; Zeitschrift für Kristallographie 188 (1989) 77–83; doi:10.1524/zkri.1989.188.14.77

data_1001380
_publ_section_title
;
 A novel form of molybdenum(V) phosphate: \d-KMo~2~P~3~O~13~
;
_journal_coden_ASTM              ZEKRDZ
_journal_issue                   1-4
_journal_name_full
;
 Zeitschrift f\"ur Kristallographie
;
_journal_page_first              77
_journal_page_last               83
_journal_paper_doi               10.1524/zkri.1989.188.14.77
_journal_volume                  188
_journal_year                    1989
_chemical_formula_structural     'K (Mo2 P3 O13)'
_chemical_formula_sum            'K Mo2 O13 P3'
_chemical_name_systematic
;
Potassium tecto-dimolybdeno(V)triphosphate - \d
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                56.488(8)
_cell_angle_beta                 55.588(7)
_cell_angle_gamma                68.868(7)
_cell_formula_units_Z            1
_cell_length_a                   8.846(8)
_cell_length_b                   8.846(9)
_cell_length_c                   10.01(1)
_cell_volume                     537.5
_refine_ls_R_factor_all          0.022
_cod_database_code               1001380
Synthesis and crystal structure of K~2~ U~2~ O~7~ and Moessbauer (^237^Np) studies of K~2~ Np~2~ O~7~ and Ca Np O~4~
Jove, J; Cousson, A; Gasperin, M; Journal of the Less-Common Metals 139 (1988) 345–350; doi:10.1016/0022-5088(88)90016-1

data_1001381
_publ_section_title
;
Synthesis and crystal structure of K~2~ U~2~ O~7~ and Moessbauer
(^237^Np) studies of K~2~ Np~2~ O~7~ and Ca Np O~4~
;
_journal_coden_ASTM              JCOMAH
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              345
_journal_page_last               350
_journal_paper_doi               10.1016/0022-5088(88)90016-1
_journal_volume                  139
_journal_year                    1988
_chemical_formula_structural     'K U O3.5'
_chemical_formula_sum            'K O3.5 U'
_chemical_name_systematic        'Potassium uranium(VI) oxide (1/1/3.5)'
_space_group_IT_number           166
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   3.96(2)
_cell_length_b                   3.96(2)
_cell_length_c                   19.82(4)
_cell_volume                     269.2
_exptl_crystal_density_meas      6.14
_refine_ls_R_factor_all          0.0445
_cod_original_sg_symbol_H-M      'R -3 m H'
_cod_database_code               1001381
Non-stoichiometric compounds with a defect CaFe~2~O~4~ structure: The mixed ferrites Ca~1-x/2~Fe~2-x~Sn~x~O~4~ and Ca~1-(x+y)/2~Li~y~Fe~2-x~Sn~x~O~4~
Archaimbault, F.; Odier, P.; Choisnet, J.; Solid State Ionics 28 (1988) 1357–1363; doi:10.1016/0167-2738(88)90387-6

data_1001382
_publ_section_title
;
 Non-stoichiometric compounds with a defect CaFe~2~O~4~ structure:
 The mixed ferrites Ca~1-x/2~Fe~2-x~Sn~x~O~4~ and
 Ca~1-(x+y)/2~Li~y~Fe~2-x~Sn~x~O~4~
;
_journal_coden_ASTM              SSIOD3
_journal_name_full               'Solid State Ionics'
_journal_page_first              1357
_journal_page_last               1363
_journal_paper_doi               10.1016/0167-2738(88)90387-6
_journal_volume                  28
_journal_year                    1988
_chemical_formula_structural     'Ca0.75 Fe1.5 Sn0.5 O4'
_chemical_formula_sum            'Ca0.75 Fe1.5 O4 Sn0.5'
_chemical_name_systematic
;
Calcium iron(III) tin(IV) oxide (.75/1.5/.5/4)
;
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   9.265
_cell_length_b                   10.945
_cell_length_c                   3.01
_cell_volume                     305.2
_refine_ls_R_factor_all          0.079
_cod_original_formula_sum        'Ca.75 Fe1.5 O4 Sn.5'
_cod_database_code               1001382
Ba (Nb~3~ O~8~)~2~ * (H~2~ O): A novel lamellar niobate
Nedjar, R; Borel, M M; Leclaire, A; Raveau, B; Materials Research Bulletin 23 (1988) 495–500; doi:

data_1001383
_publ_section_title
;
Ba (Nb~3~ O~8~)~2~ * (H~2~ O): A novel lamellar niobate
;
_journal_coden_ASTM              MRBUAC
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              495
_journal_page_last               500
_journal_volume                  23
_journal_year                    1988
_chemical_formula_structural     'Ba (Nb3 O8)2 (H2 O)'
_chemical_formula_sum            'Ba H2 Nb6 O17'
_chemical_name_systematic        'Barium bistriniobate hydrate'
_space_group_IT_number           71
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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                   8.62(2)
_cell_length_b                   21.61(4)
_cell_length_c                   3.811(4)
_cell_volume                     709.9
_refine_ls_R_factor_all          0.07
_cod_original_formula_sum        'H2 Ba Nb6 O17'
_cod_database_code               1001383
Two forms of sodium titanium(III) diphosphate: $-alpha-Na Ti P~2~ O~7~ closely related to $-beta-Cristobalite and $-beta-Na Ti P~2~ O~7~ isotypic with Na Fe P~2~ O~7~
Leclaire, A; Benmoussa, A; Borel, M M; Grandin, A; Raveau, B; Journal of Solid State Chemistry 77 (1988) 299–305; doi:10.1016/0022-4596(88)90252-6

data_1001384
_publ_section_title
;
Two forms of sodium titanium(III) diphosphate: $-alpha-Na Ti P~2~ O~7~
closely related to $-beta-Cristobalite and $-beta-Na Ti P~2~ O~7~
isotypic with Na Fe P~2~ O~7~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              299
_journal_page_last               305
_journal_paper_doi               10.1016/0022-4596(88)90252-6
_journal_volume                  77
_journal_year                    1988
_chemical_formula_structural     'Na Ti P2 O7'
_chemical_formula_sum            'Na O7 P2 Ti'
_chemical_name_systematic        'Sodium titanium(III) diphosphate - $-alpha'
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 116.54(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.697(1)
_cell_length_b                   5.239(7)
_cell_length_c                   13.293(3)
_cell_volume                     541.9
_refine_ls_R_factor_all          0.034
_cod_database_code               1001384
Two forms of sodium titanium(III) diphosphate: $-alpha-Na Ti P~2~ O~7~ closely related to $-beta-Cristobalite and $-beta-Na Ti P~2~ O~7~ isotypic with Na Fe P~2~ O~7~
Leclaire, A; Benmoussa, A; Borel, M M; Grandin, A; Raveau, B; Journal of Solid State Chemistry 77 (1988) 299–305; doi:10.1016/0022-4596(88)90252-6

data_1001385
_publ_section_title
;
Two forms of sodium titanium(III) diphosphate: $-alpha-Na Ti P~2~ O~7~
closely related to $-beta-Cristobalite and $-beta-Na Ti P~2~ O~7~
isotypic with Na Fe P~2~ O~7~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              299
_journal_page_last               305
_journal_paper_doi               10.1016/0022-4596(88)90252-6
_journal_volume                  77
_journal_year                    1988
_chemical_formula_structural     'Na Ti P2 O7'
_chemical_formula_sum            'Na O7 P2 Ti'
_chemical_name_systematic        'Sodium titanium(III) diphosphate - $-beta'
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 111.85(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.394(1)
_cell_length_b                   7.936(3)
_cell_length_c                   9.726(3)
_cell_volume                     529.7
_refine_ls_R_factor_all          0.044
_cod_database_code               1001385
Ta V O~5~, a novel derivative of the series of monophosphate tungsten bronzes (P O~2~)~4~ (W O~3~)~2m~
Chahboun, H; Groult, D; Raveau, B; Materials Research Bulletin 23 (1988) 805–812; doi:10.1016/0025-5408(88)90073-6

data_1001386
_publ_section_title
;
Ta V O~5~, a novel derivative of the series of monophosphate tungsten
bronzes (P O~2~)~4~ (W O~3~)~2m~
;
_journal_coden_ASTM              MRBUAC
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              805
_journal_page_last               812
_journal_paper_doi               10.1016/0025-5408(88)90073-6
_journal_volume                  23
_journal_year                    1988
_chemical_formula_structural     'Ta V O5'
_chemical_formula_sum            'O5 Ta V'
_chemical_name_systematic        'Tantalum vanadium oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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                   11.860(3)
_cell_length_b                   5.516(1)
_cell_length_c                   6.928(1)
_cell_volume                     453.2
_refine_ls_R_factor_all          0.085
_cod_database_code               1001386
Structure of molybdenum (IV) diphosphate Mo P~2~ O~7~
Leclaire, A; Borel, M M; Grandin, A; Raveau, B; European Journal of Solid State Inorganic Chemistry 25 (1988) 323–327; doi:

data_1001387
_publ_section_title
;
Structure of molybdenum (IV) diphosphate Mo P~2~ O~7~
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              323
_journal_page_last               327
_journal_volume                  25
_journal_year                    1988
_chemical_formula_structural     'Mo P2 O7'
_chemical_formula_sum            'Mo O7 P2'
_chemical_name_systematic        'Molybdenum(IV) diphosphate'
_space_group_IT_number           205
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   7.944(1)
_cell_length_b                   7.944(1)
_cell_length_c                   7.944(1)
_cell_volume                     501.3
_refine_ls_R_factor_all          0.048
_cod_database_code               1001387