LMucko/crystallography-open-database huggingface dataset:
Crystal Structure of Li~3~ Th F~7~ solved by X-Ray and Neutron Diffraction
Laligant, Y; Le Bail, A; Avignant, D; Cousseins, J C; Ferey, G; Journal of Solid State Chemistry 80 (1989) 206–212; doi:10.1016/0022-4596(89)90081-9

data_1000074
_publ_section_title
;
Crystal Structure of Li~3~ Th F~7~ solved by X-Ray and Neutron
Diffraction
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              206
_journal_page_last               212
_journal_paper_doi               10.1016/0022-4596(89)90081-9
_journal_volume                  80
_journal_year                    1989
_chemical_formula_structural     'Li3 Th F7'
_chemical_formula_sum            'F7 Li3 Th'
_chemical_name_systematic        'Trilithium thorium fluoride'
_space_group_IT_number           68
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-C 2a 2ac'
_symmetry_space_group_name_H-M   'C c c a :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.7590(2)
_cell_length_b                   8.7280(2)
_cell_length_c                   12.8956(3)
_cell_volume                     985.8
_refine_ls_R_factor_all          0.1152
_cod_original_sg_symbol_H-M      'C c c a Z'
_cod_database_code               1000074
Complex Palladium Oxides. V. Crystal Structure of Li Bi Pd~2~ O~4~: An Example of Three Different Fourfold Coordinations of Cations
Laligant, Y; Le Bail, A; Ferey, G; Journal of Solid State Chemistry 81 (1989) 58–64; doi:10.1016/0022-4596(89)90201-6

data_1000075
_publ_section_title
;
Complex Palladium Oxides. V. Crystal Structure of Li Bi Pd~2~ O~4~: An
Example of Three Different Fourfold Coordinations of Cations
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              58
_journal_page_last               64
_journal_paper_doi               10.1016/0022-4596(89)90201-6
_journal_volume                  81
_journal_year                    1989
_chemical_formula_structural     'Li Bi Pd2 O4'
_chemical_formula_sum            'Bi Li O4 Pd2'
_chemical_name_systematic        'Lithium bismuth dipalladium oxide'
_space_group_IT_number           129
_symmetry_cell_setting           tetragonal
_symmetry_space_group_name_Hall  '-P 4a 2a'
_symmetry_space_group_name_H-M   'P 4/n m m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.9109(2)
_cell_length_b                   6.9109(2)
_cell_length_c                   4.3557(2)
_cell_volume                     208.0
_refine_ls_R_factor_all          0.0412
_cod_original_sg_symbol_H-M      'P 4/n m m Z'
_cod_database_code               1000075
Crystal Structure of Na~3~ Sr~4~ Al~5~ F~26~
Hemon, A; Le Bail, A; Courbion, G; Journal of Solid State Chemistry 81 (1989) 299–304; doi:10.1016/0022-4596(89)90018-2

data_1000076
_publ_section_title
;
Crystal Structure of Na~3~ Sr~4~ Al~5~ F~26~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              299
_journal_page_last               304
_journal_paper_doi               10.1016/0022-4596(89)90018-2
_journal_volume                  81
_journal_year                    1989
_chemical_formula_structural     'Na3 Sr4 Al5 F26'
_chemical_formula_sum            'Al5 F26 Na3 Sr4'
_chemical_name_systematic
;
Trisodium tetrastrontium 26-fluoropentaaluminate
;
_space_group_IT_number           86
_symmetry_cell_setting           tetragonal
_symmetry_space_group_name_Hall  '-P 4bc'
_symmetry_space_group_name_H-M   'P 42/n :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.2679(5)
_cell_length_b                   10.2679(5)
_cell_length_c                   18.373(2)
_cell_volume                     1937.1
_refine_ls_R_factor_all          0.029
_cod_original_sg_symbol_H-M      'P 42/n Z'
_cod_database_code               1000076
Les varietes "bronze de tungstene hexagonal" des trifluorures CrF~3~ et VF~3~
de Pape, R; Le Bail, A; Lubin, F; Ferey, G; Revue de Chimie Minerale 24 (1987) 545–551; doi:

data_1000077
_publ_section_title
;
Les varietes "bronze de tungstene hexagonal" des trifluorures CrF~3~ et
VF~3~
;
_journal_coden_ASTM              RVCMA8
_journal_name_full               'Revue de Chimie Minerale'
_journal_page_first              545
_journal_page_last               551
_journal_volume                  24
_journal_year                    1987
_chemical_formula_structural     'Cr F3 (N H3)0.0333'
_chemical_formula_sum            'Cr F3 H0.0999 N0.0333'
_chemical_name_systematic        'Chromium fluoride ammonia *'
_space_group_IT_number           63
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   7.276(2)
_cell_length_b                   12.480(3)
_cell_length_c                   7.364(2)
_cell_volume                     668.7
_refine_ls_R_factor_all          0.039
_cod_original_formula_sum        'H.0999 Cr F3 N.0333'
_cod_database_code               1000077
Les varietes "bronze de tungstene hexagonal" des trifluorures CrF~3~ et VF~3~
de Pape, R; Le Bail, A; Lubin, F; Ferey, G; Revue de Chimie Minerale 24 (1987) 545–551; doi:

data_1000078
_publ_section_title
;
Les varietes "bronze de tungstene hexagonal" des trifluorures CrF~3~ et
VF~3~
;
_journal_coden_ASTM              RVCMA8
_journal_name_full               'Revue de Chimie Minerale'
_journal_page_first              545
_journal_page_last               551
_journal_volume                  24
_journal_year                    1987
_chemical_formula_structural     'V F3 (N H3)0.0267'
_chemical_formula_sum            'F3 H0.0801 N0.0267 V'
_chemical_name_systematic        'Vanadium(III) fluoride (0.03/1/3)'
_space_group_IT_number           63
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   7.425(9)
_cell_length_b                   12.835(17)
_cell_length_c                   7.563(2)
_cell_volume                     720.8
_refine_ls_R_factor_all          0.047
_cod_original_formula_sum        'H.0801 F3 N.0267 V'
_cod_database_code               1000078
Crystal structure of A(VO~2~)(HPO~4~)(A=NH~4~^+^,K^+^, Rb^+^) solved from X-ray powder diffraction
Amoros, P; Beltran-Porter, D; Le Bail, A; Ferey, G; Villeneuve, G; European Journal of Solid State Inorganic Chemistry 25 (1988) 599–607; doi:

data_1000079
_publ_section_title
;
Crystal structure of A(VO~2~)(HPO~4~)(A=NH~4~^+^,K^+^, Rb^+^) solved
from X-ray powder diffraction
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              599
_journal_page_last               607
_journal_volume                  25
_journal_year                    1988
_chemical_formula_structural     'K (V O2) (H P O4)'
_chemical_formula_sum            'H K O6 P V'
_chemical_name_systematic        'Potassium dioxovanadium hydrogenphosphate'
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   6.7550(3)
_cell_length_b                   9.1026(4)
_cell_length_c                   17.0808(6)
_cell_volume                     1050.3
_refine_ls_R_factor_all          0.043
_cod_database_code               1000079
Crystal structure of A(VO~2~)(HPO~4~)(A=NH~4~^+^,K^+^, Rb^+^) solved from X-ray powder diffraction
Amoros, P; Beltran-Porter, D; Le Bail, A; Ferey, G; Villeneuve, G; European Journal of Solid State Inorganic Chemistry 25 (1988) 599–607; doi:

data_1000080
_publ_section_title
;
Crystal structure of A(VO~2~)(HPO~4~)(A=NH~4~^+^,K^+^, Rb^+^) solved
from X-ray powder diffraction
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              599
_journal_page_last               607
_journal_volume                  25
_journal_year                    1988
_chemical_formula_structural     '(N H4) (V O2) (H P O4)'
_chemical_formula_sum            'H5 N O6 P V'
_chemical_name_systematic        'Ammonium dioxovanadium hydrogenphosphate'
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   6.8064(6)
_cell_length_b                   9.2567(7)
_cell_length_c                   17.732(2)
_cell_volume                     1117.2
_refine_ls_R_factor_all          0.047
_cod_database_code               1000080
Crystal structure of A(VO~2~)(HPO~4~)(A=NH~4~^+^,K^+^, Rb^+^) solved from X-ray powder diffraction
Amoros, P; Beltran-Porter, D; Le Bail, A; Ferey, G; Villeneuve, G; European Journal of Solid State Inorganic Chemistry 25 (1988) 599–607; doi:

data_1000081
_publ_section_title
;
Crystal structure of A(VO~2~)(HPO~4~)(A=NH~4~^+^,K^+^, Rb^+^) solved
from X-ray powder diffraction
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              599
_journal_page_last               607
_journal_volume                  25
_journal_year                    1988
_chemical_formula_structural     'Rb (V O2) (H P O4)'
_chemical_formula_sum            'H O6 P Rb V'
_chemical_name_systematic        'Rubidium dioxovanadium hydrogenphosphate'
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   6.8182(8)
_cell_length_b                   9.291(1)
_cell_length_c                   17.631(2)
_cell_volume                     1116.9
_refine_ls_R_factor_all          0.045
_cod_database_code               1000081
Crystal structure of Rb~2~NaAl~6~F~21~; a new term of the A~2~Na(Al~x~F~3x+1~)~3~ family (A= Rb, Cs)
Le Bail, A; Gao, Y; Jacoboni, C; European Journal of Solid State Inorganic Chemistry 26 (1989) 281–288; doi:

data_1000082
_publ_section_title
;
Crystal structure of Rb~2~NaAl~6~F~21~; a new term of the
A~2~Na(Al~x~F~3x+1~)~3~ family (A= Rb, Cs)
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              281
_journal_page_last               288
_journal_volume                  26
_journal_year                    1989
_chemical_formula_structural     'Rb2 Na Al6 F21'
_chemical_formula_sum            'Al6 F21 Na Rb2'
_chemical_name_systematic        'Dirubidium sodium hexaaluminium fluoride'
_space_group_IT_number           5
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      5
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.20(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.075(6)
_cell_length_b                   6.972(3)
_cell_length_c                   10.214(5)
_cell_volume                     790.4
_refine_ls_R_factor_all          0.04
_cod_database_code               1000082
Structure of vanadyl hydrogenphosphate dihydrate α-VO(HPO~4~) 2H~2~O solved from X-ray and neutron powder diffraction
Le Bail, A.; Ferey, G.; Amoros, P.; Beltran-Portier, D.; European Journal of Solid State and Inorganic Chemistry 26 (1989) 419–426; doi:

data_1000083
_publ_section_title
;
 Structure of vanadyl hydrogenphosphate dihydrate \a-VO(HPO~4~)
 2H~2~O solved from X-ray and neutron powder diffraction
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
 European Journal of Solid State and Inorganic Chemistry
;
_journal_page_first              419
_journal_page_last               426
_journal_volume                  26
_journal_year                    1989
_chemical_formula_structural     '(V O) (H P O4) (H2 O)2'
_chemical_formula_sum            'H5 O7 P V'
_chemical_name_systematic
;
Oxovanadium(IV) hydrogenphosphate dihydrate - \a
;
_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                 95.44(8)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.613(5)
_cell_length_b                   7.431(5)
_cell_length_c                   9.482(7)
_cell_volume                     534.0
_refine_ls_R_factor_all          0.041
_cod_database_code               1000083
Structure of vanadyl hydrogenphosphate dihydrate α-VO(HPO~4~) 2H~2~O solved from X-ray and neutron powder diffraction
Le Bail, A.; Ferey, G.; Amoros, P.; Beltran-Portier, D.; European Journal of Solid State and Inorganic Chemistry 26 (1989) 419–426; doi:

data_1000084
_publ_section_title
;
 Structure of vanadyl hydrogenphosphate dihydrate \a-VO(HPO~4~)
 2H~2~O solved from X-ray and neutron powder diffraction
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
 European Journal of Solid State and Inorganic Chemistry
;
_journal_page_first              419
_journal_page_last               426
_journal_volume                  26
_journal_year                    1989
_chemical_formula_structural     '(V O) (H P O4) (H2 O)2'
_chemical_formula_sum            'H5 O7 P V'
_chemical_name_systematic
;
Oxovanadium(IV) hydrogenphosphate dihydrate - \a
;
_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                 95.4(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.61(1)
_cell_length_b                   7.42(1)
_cell_length_c                   9.47(1)
_cell_volume                     532.4
_refine_ls_R_factor_all          0.034
_cod_database_code               1000084
Crystal structure determination of Rb~2~Cr~5~F~17~
Laligant, Y; Le Bail, A; Ferey, G; European Journal of Solid State Inorganic Chemistry 26 (1989) 445–454; doi:

data_1000085
_publ_section_title
;
Crystal structure determination of Rb~2~Cr~5~F~17~
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              445
_journal_page_last               454
_journal_volume                  26
_journal_year                    1989
_chemical_formula_structural     'Rb2 Cr5 F17'
_chemical_formula_sum            'Cr5 F17 Rb2'
_chemical_name_systematic        'Dirubidium pentachromium fluoride'
_space_group_IT_number           63
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.418(2)
_cell_length_b                   25.670(5)
_cell_length_c                   14.624(2)
_cell_volume                     2784.7
_refine_ls_R_factor_all          0.056
_cod_database_code               1000085
Crystal structure and protonic conductivity of pyrochlore phases Al~2~((O H)~1-x~ F~x~)~6~ . H~2~O and Al~2~((O H)~1-x~F~x~)~6~ (x=0.5)
Fourquet, J L; Riviere, M; Le Bail, A; Nygrens, M; Grins, J; European Journal of Solid State Inorganic Chemistry 25 (1988) 535–540; doi:

data_1000086
_publ_section_title
;
Crystal structure and protonic conductivity of pyrochlore phases
Al~2~((O H)~1-x~ F~x~)~6~ . H~2~O and Al~2~((O H)~1-x~F~x~)~6~
(x=0.5)
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              535
_journal_page_last               540
_journal_volume                  25
_journal_year                    1988
_chemical_formula_structural     'Al2 ((O H).46 F.54)6 (H2 O)'
_chemical_formula_sum            'Al2 F3.24 H4.76 O3.76'
_chemical_name_systematic
;
Aluminium hydroxide fluoride hydrate (2/2.8/3.2/1)
;
_space_group_IT_number           227
_symmetry_cell_setting           cubic
_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                   9.8614(2)
_cell_length_b                   9.8614(2)
_cell_length_c                   9.8614(2)
_cell_volume                     959.0
_refine_ls_R_factor_all          0.0124
_cod_original_sg_symbol_H-M      'F d -3 m Z'
_cod_original_formula_sum        'H4.76 Al2 F3.24 O3.76'
_cod_database_code               1000086
Crystal structure and protonic conductivity of pyrochlore phases Al~2~((O H)~1-x~ F~x~)~6~ . H~2~O and Al~2~((O H)~1-x~F~x~)~6~ (x=0.5)
Fourquet, J L; Riviere, M; Le Bail, A; Nygrens, M; Grins, J; European Journal of Solid State Inorganic Chemistry 25 (1988) 535–540; doi:

data_1000087
_publ_section_title
;
Crystal structure and protonic conductivity of pyrochlore phases
Al~2~((O H)~1-x~ F~x~)~6~ . H~2~O and Al~2~((O H)~1-x~F~x~)~6~
(x=0.5)
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              535
_journal_page_last               540
_journal_volume                  25
_journal_year                    1988
_chemical_formula_structural     'Al2 ((O H).5 F.5)6'
_chemical_formula_sum            'Al2 F3 H3 O3'
_chemical_name_systematic        'Dialuminium trihydroxide trifluoride'
_space_group_IT_number           227
_symmetry_cell_setting           cubic
_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                   9.7490(6)
_cell_length_b                   9.7490(6)
_cell_length_c                   9.7490(6)
_cell_volume                     926.6
_refine_ls_R_factor_all          0.0268
_cod_original_sg_symbol_H-M      'F d -3 m Z'
_cod_original_formula_sum        'H3 Al2 F3 O3'
_cod_database_code               1000087
Determination of the crystal structure of Li~2~ Tb F~6~ from X-ray and neutron powder diffraction. An example of lithium in five-fold coordination.
Laligant, Y; Le Bail, A; Ferey, G; Avignant, D; Cousseins, J C; European Journal of Solid State Inorganic Chemistry 25 (1988) 551–563; doi:

data_1000088
_publ_section_title
;
Determination of the crystal structure of Li~2~ Tb F~6~ from X-ray and
neutron powder diffraction. An example of lithium in five-fold
coordination.
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              551
_journal_page_last               563
_journal_volume                  25
_journal_year                    1988
_chemical_formula_structural     'Li2 Tb F6'
_chemical_formula_sum            'F6 Li2 Tb'
_chemical_name_systematic        'Dilithium terbium(IV) fluoride'
_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                 106.96(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.585(1)
_cell_length_b                   4.965(1)
_cell_length_c                   11.116(2)
_cell_volume                     400.4
_refine_ls_R_factor_all          0.0372
_cod_database_code               1000088
Determination of the crystal structure of Li~2~ Tb F~6~ from X-ray and neutron powder diffraction. An example of lithium in five-fold coordination.
Laligant, Y; Le Bail, A; Ferey, G; Avignant, D; Cousseins, J C; European Journal of Solid State Inorganic Chemistry 25 (1988) 551–563; doi:

data_1000089
_publ_section_title
;
Determination of the crystal structure of Li~2~ Tb F~6~ from X-ray and
neutron powder diffraction. An example of lithium in five-fold
coordination.
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              551
_journal_page_last               563
_journal_volume                  25
_journal_year                    1988
_chemical_formula_structural     'Li2 Tb F6'
_chemical_formula_sum            'F6 Li2 Tb'
_chemical_name_systematic        'Dilithium terbium(IV) fluoride'
_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                 107.02(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.560(1)
_cell_length_b                   4.934(1)
_cell_length_c                   11.066(1)
_cell_volume                     394.7
_refine_ls_R_factor_all          0.0156
_cod_database_code               1000089
Reinvestigation of the structure of K~2~FeF~5~
Le Bail, A; Desert, A; Fourquet, J L; Journal of Solid State Chemistry 84 (1990) 408–412; doi:10.1016/0022-4596(90)90338-X

data_1000090
_publ_section_title
;
Reinvestigation of the structure of K~2~FeF~5~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              408
_journal_page_last               412
_journal_paper_doi               10.1016/0022-4596(90)90338-X
_journal_volume                  84
_journal_year                    1990
_chemical_formula_structural     'K2 (Fe F5)'
_chemical_formula_sum            'F5 Fe K2'
_chemical_name_systematic        'Potassium pentafluoroferrate(III)'
_space_group_IT_number           60
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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            16
_cell_length_a                   7.4059(4)
_cell_length_b                   12.8771(9)
_cell_length_c                   20.4282(13)
_cell_volume                     1948.2
_refine_ls_R_factor_all          0.036
_cod_database_code               1000090