LMucko/crystallography-open-database huggingface dataset:
Oxynitride perovskites: synthesis and structures of La Zr O2 N, Nd Ti O2 N and La Ti O2 N and comparison with oxide perovskites
Clarke, S.J.; Guinot, B.P.; Michie, C.W.; Calmont, M.J.C.; Rosseinsky, M.J.; Chemistry of Materials (1,1989-) 14 (2002) 288–294; doi:10.1021/cm010577v

data_4002461
_publ_section_title
;
 Oxynitride perovskites: synthesis and structures of La Zr O2 N, Nd Ti O2
 N and La Ti O2 N and comparison with oxide perovskites
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_paper_doi               10.1021/cm010577v
_journal_page_first              288
_journal_page_last               294
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'N0.83 Nd O2.17 Ti'
_chemical_name_systematic        'Nd (Ti O2.17 N0.83)'
_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                   5.5492
_cell_length_b                   7.8017
_cell_length_c                   5.52901
_cell_volume                     239.369
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Clarke_CMATEX_2002_237.cif
_cod_data_source_block           N0.83Nd1O2.17Ti1
_cod_original_cell_volume        239.3685
_cod_original_formula_sum        'N0.83 Nd1 O2.17 Ti1'
_cod_database_code               4002461
Structure investigations of single crystals of stishovite
Bolotina, N.B.; Bendeliani, N.A.; Lityagina, L.M.; Dyuzheva, T.I.; Poverkhnostnye Fizika, Khimiya, Mekhanika 2002 (2002) 20–24; doi:

data_1531202
_publ_section_title
;
 Structure investigations of single crystals of stishovite
;
_journal_name_full               'Poverkhnostnye Fizika, Khimiya, Mekhanika'
_journal_page_first              20
_journal_page_last               24
_journal_volume                  2002
_journal_year                    2002
_chemical_formula_sum            'O2 Si1.016'
_chemical_name_systematic        'Si1.016 O2'
_space_group_IT_number           143
_symmetry_space_group_name_Hall  'P 3'
_symmetry_space_group_name_H-M   'P 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   8.31
_cell_length_b                   8.31
_cell_length_c                   5.205
_cell_volume                     311.282
_citation_journal_id_ASTM        PFKMDJ
_cod_data_source_file            Bolotina_PFKMDJ_2002_1990.cif
_cod_data_source_block           O2Si1.016
_cod_original_cell_volume        311.2816
_cod_database_code               1531202
The crystal structure of Fe In Ge2 O7
Bucio, L.; Garcia-Robledo, J.; Ruvalcaba-Sil, J.L.; Orozco, E.; Zeitschrift fuer Kristallographie (149,1979-) 216 (2001) 438–441; doi:

data_8103740
_publ_section_title
;
 The crystal structure of Fe In Ge2 O7
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              438
_journal_page_last               441
_journal_volume                  216
_journal_year                    2001
_chemical_formula_sum            'Fe Ge2 In O7'
_chemical_name_systematic        'Fe In Ge2 O7'
_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                 102.683
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.5124
_cell_length_b                   8.5914
_cell_length_c                   4.8936
_cell_volume                     267.119
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Bucio_ZEKRDZ_2001_69.cif
_cod_data_source_block           Fe1Ge2In1O7
_cod_original_cell_volume        267.1192
_cod_original_formula_sum        'Fe1 Ge2 In1 O7'
_cod_database_code               8103740
Oxynitride perovskites: synthesis and structures of La Zr O2 N, Nd Ti O2 N and La Ti O2 N and comparison with oxide perovskites
Clarke, S.J.; Guinot, B.P.; Michie, C.W.; Calmont, M.J.C.; Rosseinsky, M.J.; Chemistry of Materials (1,1989-) 14 (2002) 288–294; doi:10.1021/cm010577v

data_4002462
_publ_section_title
;
 Oxynitride perovskites: synthesis and structures of La Zr O2 N, Nd Ti O2
 N and La Ti O2 N and comparison with oxide perovskites
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_paper_doi               10.1021/cm010577v
_journal_page_first              288
_journal_page_last               294
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'La N1.06 O1.94 Zr'
_chemical_name_systematic        'La (Zr O1.94 N1.06)'
_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                   5.87525
_cell_length_b                   8.25031
_cell_length_c                   5.81008
_cell_volume                     281.630
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Clarke_CMATEX_2002_238.cif
_cod_data_source_block           La1N1.06O1.94Zr1
_cod_original_cell_volume        281.6299
_cod_original_formula_sum        'La1 N1.06 O1.94 Zr1'
_cod_database_code               4002462
Gatelite-(Ce), a new REE-bearing mineral from Trimouns, French Pyrenees: crystal structure and polysomatic relationships with epidote and tornebohmite-(Ce)
Bonazzi, P.; Bindi, L.; Parodi, G.C.; American Mineralogist 88 (2003) 223–228; doi:

data_1531203
_publ_section_title
;
 Gatelite-(Ce), a new REE-bearing mineral from Trimouns, French Pyrenees:
 crystal structure and polysomatic relationships with epidote and
 tornebohmite-(Ce)
;
_journal_name_full               'American Mineralogist'
_journal_page_first              223
_journal_page_last               228
_journal_volume                  88
_journal_year                    2003
_chemical_formula_sum
'Al3.13 Ca Ce1.54 F0.14 Fe0.33 H1.6 La0.61 Mg0.53 Nd0.85 O21.86 Si5'
_chemical_name_systematic
;
(Ca (La0.61 Ce1.54 Nd0.85)) (Al2 (Al0.8 Mg0.2) (Al0.33 Mg0.33 Fe0.33)) (Si 
O4)3 (Si2 O7) (O0.86 F0.14) (O0.4 (O H)1.6)
;
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 116.18
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   17.77
_cell_length_b                   5.651
_cell_length_c                   17.458
_cell_volume                     1573.256
_citation_journal_id_ASTM        AMMIAY
_cod_data_source_file            Bonazzi_AMMIAY_2003_1797.cif
_cod_data_source_block
H1.6Al3.13Ca1Ce1.54F0.14Fe0.33La0.61Mg0.53Nd0.85O21.86Si5
_cod_original_sg_symbol_Hall     '-P 2ybc (z,y,-x)'
_cod_original_formula_sum
;
H1.6 Al3.13 Ca1 Ce1.54 F0.14 Fe0.33 La0.61 Mg0.53 Nd0.85 O21.86 Si5
;
_cod_database_code               1531203
The system Yb - Co - P
Budnyk, S.; Kuz'ma, Yu.B.; Polish Journal of Chemistry 76 (2002) 1553–1558; doi:

data_1531204
_publ_section_title
;
 The system Yb - Co - P
;
_journal_name_full               'Polish Journal of Chemistry'
_journal_page_first              1553
_journal_page_last               1558
_journal_volume                  76
_journal_year                    2002
_chemical_formula_sum            'Co12 P7 Yb2'
_chemical_name_systematic        'Yb2 Co12 P7'
_space_group_IT_number           174
_symmetry_space_group_name_Hall  'P -6'
_symmetry_space_group_name_H-M   'P -6'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   9.02654
_cell_length_b                   9.02654
_cell_length_c                   3.58185
_cell_volume                     252.744
_citation_journal_id_ASTM        PJCHDQ
_cod_data_source_file            Budnyk_PJCHDQ_2002_1991.cif
_cod_data_source_block           Co12P7Yb2
_cod_original_cell_volume        252.7439
_cod_database_code               1531204
Oxynitride perovskites: synthesis and structures of La Zr O2 N, Nd Ti O2 N and La Ti O2 N and comparison with oxide perovskites
Clarke, S.J.; Guinot, B.P.; Michie, C.W.; Rosseinsky, M.J.; Calmont, M.J.C.; Chemistry of Materials (1,1989-) 14 (2002) 288–294; doi:10.1021/cm010577v

data_4002463
_publ_section_title
;
 Oxynitride perovskites: synthesis and structures of La Zr O2 N, Nd Ti O2
 N and La Ti O2 N and comparison with oxide perovskites
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_paper_doi               10.1021/cm010577v
_journal_page_first              288
_journal_page_last               294
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'La N O2 Ti'
_chemical_name_systematic        'La (Ti O2 N)'
_space_group_IT_number           2
_symmetry_space_group_name_Hall
'-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)'
_symmetry_space_group_name_H-M   'I -1'
_cell_angle_alpha                90.199
_cell_angle_beta                 90.154
_cell_angle_gamma                89.988
_cell_formula_units_Z            4
_cell_length_a                   5.6097
_cell_length_b                   7.8719
_cell_length_c                   5.5752
_cell_volume                     246.193
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Clarke_CMATEX_2002_239.cif
_cod_data_source_block           La1N1O2Ti1
_cod_original_cell_volume        246.1929
_cod_original_sg_symbol_Hall
;
-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)
;
_cod_original_sg_symbol_H-M      'P -1 (b+c,a+c,a+b)'
_cod_original_formula_sum        'La1 N1 O2 Ti1'
_cod_database_code               4002463
Metamict aeschynite-(Y) from the Evje-Iveland district (Norway): heat-induced recrystallization and dehydrogenation
Bonazzi, P.; Dei, L.; Zoppi, M.; European Journal of Mineralogy (1,1989-) 14 (2002) 141–150; doi:

data_1531205
_publ_section_title
;
 Metamict aeschynite-(Y) from the Evje-Iveland district (Norway):
 heat-induced recrystallization and dehydrogenation
;
_journal_name_full               'European Journal of Mineralogy (1,1989-)'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum
'Ca0.012 Dy0.25 Fe0.018 H0.28 Nb0.335 O6 Ta0.05 Th0.157 Ti1.605 U0.056 W0.014 Y0.5'
_chemical_name_systematic
;
(Y0.50 Dy0.25 Th0.157 U0.056 Ca0.012) (Ti1.605 Nb0.335 Ta0.05 W0.014 Fe0.018) 
O5.72 (O H)0.28
;
_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                   10.8637
_cell_length_b                   7.4406
_cell_length_c                   5.1717
_cell_volume                     418.041
_citation_journal_id_ASTM        EJMIER
_cod_data_source_file            Bonazzi_EJMIER_2002_282.cif
_cod_data_source_block
H0.28Ca0.012Dy0.25Fe0.018Nb0.335O6Ta0.05Th0.157Ti1.605U0.056W0.014Y0.5
_cod_original_cell_volume        418.0412
_cod_original_formula_sum
;
H0.28 Ca0.012 Dy0.25 Fe0.018 Nb0.335 O6 Ta0.05 Th0.157 Ti1.605 U0.056 W0.014 
Y0.5
;
_cod_database_code               1531205
The system Yb - Co - P
Budnyk, S.; Kuz'ma, Yu.B.; Polish Journal of Chemistry 76 (2002) 1553–1558; doi:

data_1531206
_publ_section_title
;
 The system Yb - Co - P
;
_journal_name_full               'Polish Journal of Chemistry'
_journal_page_first              1553
_journal_page_last               1558
_journal_volume                  76
_journal_year                    2002
_chemical_formula_sum            'Co3 P2 Yb'
_chemical_name_systematic        'Yb Co3 P2'
_space_group_IT_number           59
_symmetry_space_group_name_Hall  '-P 2ab 2a'
_symmetry_space_group_name_H-M   'P m m n :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            6
_cell_length_a                   10.6344
_cell_length_b                   3.7712
_cell_length_c                   12.3501
_cell_volume                     495.294
_citation_journal_id_ASTM        PJCHDQ
_cod_data_source_file            Budnyk_PJCHDQ_2002_1992.cif
_cod_data_source_block           Co3P2Yb1
_cod_original_cell_volume        495.2939
_cod_original_formula_sum        'Co3 P2 Yb1'
_cod_database_code               1531206
High-temperature synthesis and structures of perovskite and n = 1 Ruddlesden-Popper tantalum oxynitrides
Clarke, S.J.; Hardstone, K.A.; Rosseinsky, M.J.; Michie, C.W.; Chemistry of Materials (1,1989-) 14 (2002) 2664–2669; doi:

data_4002464
_publ_section_title
;
 High-temperature synthesis and structures of perovskite and n = 1
 Ruddlesden-Popper tantalum oxynitrides
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              2664
_journal_page_last               2669
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'N O2 Sr Ta'
_chemical_name_systematic        'Sr (Ta O2 N)'
_space_group_IT_number           140
_symmetry_space_group_name_Hall  '-I 4 2c'
_symmetry_space_group_name_H-M   'I 4/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.69411
_cell_length_b                   5.69411
_cell_length_c                   8.0658
_cell_volume                     261.517
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Clarke_CMATEX_2002_671.cif
_cod_data_source_block           N1O2Sr1Ta1
_cod_original_cell_volume        261.5165
_cod_original_formula_sum        'N1 O2 Sr1 Ta1'
_cod_database_code               4002464
New ternary phosphide La7 Pd17 P12: preparation and crystal structure
Budnyk, S.L.; Prots', Yu.; Kuz'ma, Yu.B.; Grin', Yu.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 57 (2002) 1409–1413; doi:

data_7222162
_publ_section_title
;
 New ternary phosphide La7 Pd17 P12: preparation and crystal structure
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              1409
_journal_page_last               1413
_journal_volume                  57
_journal_year                    2002
_chemical_formula_sum            'La7 P12 Pd17'
_chemical_name_systematic        'La7 Pd17 P12'
_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                 112.129
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   24.519
_cell_length_b                   4.0859
_cell_length_c                   13.6106
_cell_volume                     1263.099
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Budnyk_ZNBSEN_2002_1091.cif
_cod_data_source_block           La7P12Pd17
_cod_database_code               7222162
High-temperature synthesis and structures of perovskite and n = 1 Ruddlesden-Popper tantalum oxynitrides
Clarke, S.J.; Hardstone, K.A.; Michie, C.W.; Rosseinsky, M.J.; Chemistry of Materials (1,1989-) 14 (2002) 2664–2669; doi:

data_4002465
_publ_section_title
;
 High-temperature synthesis and structures of perovskite and n = 1
 Ruddlesden-Popper tantalum oxynitrides
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              2664
_journal_page_last               2669
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'Ba2 N0.97 O3.03 Ta'
_chemical_name_systematic        'Ba2 (Ta (O3.03 N0.97))'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.11508
_cell_length_b                   4.11508
_cell_length_c                   13.3778
_cell_volume                     226.538
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Clarke_CMATEX_2002_672.cif
_cod_data_source_block           Ba2N0.97O3.03Ta1
_cod_original_cell_volume        226.5381
_cod_original_formula_sum        'Ba2 N0.97 O3.03 Ta1'
_cod_database_code               4002465
The salts and double salts of rare earths. II. Crystal structure of cesium bis-sulfato tri-aquo praseodimate(III) monohydrate
Bukovec, P.; Golic, L.; Documenta Chemica Yugoslavica. Vestnik Slovenskega Kemijskega Drustva 22 (1975) 19–25; doi:

data_1531207
_publ_section_title
;
 The salts and double salts of rare earths. II. Crystal structure of
 cesium bis-sulfato tri-aquo praseodimate(III) monohydrate
;
_journal_name_full
;
Documenta Chemica Yugoslavica. Vestnik Slovenskega Kemijskega Drustva
;
_journal_page_first              19
_journal_page_last               25
_journal_volume                  22
_journal_year                    1975
_chemical_formula_sum            'Cs H8 O12 Pr S2'
_chemical_name_systematic        'Cs (Pr (H2 O)3 (S O4)2) (H2 O)'
_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                 94.55
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.671
_cell_length_b                   19.054
_cell_length_c                   8.839
_cell_volume                     1119.978
_citation_journal_id_ASTM        VSKDAA
_cod_data_source_file            Bukovec_VSKDAA_1975_1590.cif
_cod_data_source_block           H8Cs1O12Pr1S2
_cod_original_formula_sum        'H8 Cs1 O12 Pr1 S2'
_cod_database_code               1531207
A first transition series pseudotetrahedral oxynitride anion: synthesis and characterization of Ba2 V O3 N
Clarke, S.J.; Puyet, M.; Chalker, P.R.; Holman, J.; Michie, C.W.; Rosseinsky, M.J.; Journal of the American Chemical Society 124 (2002) 3337–3342; doi:

data_4124486
_publ_section_title
;
 A first transition series pseudotetrahedral oxynitride anion: synthesis
 and characterization of Ba2 V O3 N
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              3337
_journal_page_last               3342
_journal_volume                  124
_journal_year                    2002
_chemical_formula_sum            'Ba2 N O3 V'
_chemical_name_systematic        'Ba2 (V O3 N)'
_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                   7.70736
_cell_length_b                   5.92871
_cell_length_c                   10.50584
_cell_volume                     480.061
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Clarke_JACSAT_2002_331.cif
_cod_data_source_block           Ba2N1O3V1
_cod_original_cell_volume        480.0612
_cod_original_formula_sum        'Ba2 N1 O3 V1'
_cod_database_code               4124486
Magnetism and structural chemistry of the n=1 Ruddlesden-Popper phases La4 Li Mn O8 and La3 Sr Li Mn O8
Burley, J.C.; Battle, P.D.; Gallon, D.J.; Sloan, J.; Grey, C.P.; Rosseinsky, M.J.; Journal of the American Chemical Society 124 (2002) 620–628; doi:

data_4124487
_publ_section_title
;
 Magnetism and structural chemistry of the n=1 Ruddlesden-Popper phases
 La4 Li Mn O8 and La3 Sr Li Mn O8
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              620
_journal_page_last               628
_journal_volume                  124
_journal_year                    2002
_chemical_formula_sum            'La4 Li Mn O8'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.78709
_cell_length_b                   3.78709
_cell_length_c                   12.9561
_cell_volume                     185.817
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Burley_JACSAT_2002_344.cif
_cod_data_source_block           La4Li1Mn1O8
_cod_original_cell_volume        185.8171
_cod_original_formula_sum        'La4 Li1 Mn1 O8'
_cod_database_code               4124487
Metamict aeschynite-(Y) from the Evje-Iveland district (Norway): heat-induced recrystallization and dehydrogenation
Bonazzi, P.; Zoppi, M.; Dei, L.; European Journal of Mineralogy (1,1989-) 14 (2002) 141–150; doi:

data_1531208
_publ_section_title
;
 Metamict aeschynite-(Y) from the Evje-Iveland district (Norway):
 heat-induced recrystallization and dehydrogenation
;
_journal_name_full               'European Journal of Mineralogy (1,1989-)'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum
'Ca0.012 Dy0.25 Fe0.018 H0.28 Nb0.335 O6 Ta0.05 Th0.157 Ti1.605 U0.056 W0.014 Y0.5'
_chemical_name_systematic
;
(Y0.50 Dy0.25 Th0.157 U0.056 Ca0.012) (Ti1.605 Nb0.335 Ta0.05 W0.014 Fe0.018) 
O5.72 (O H)0.28
;
_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                   14.5342
_cell_length_b                   5.5584
_cell_length_c                   5.1952
_cell_volume                     419.704
_citation_journal_id_ASTM        EJMIER
_cod_data_source_file            Bonazzi_EJMIER_2002_286.cif
_cod_data_source_block
H0.28Ca0.012Dy0.25Fe0.018Nb0.335O6Ta0.05Th0.157Ti1.605U0.056W0.014Y0.5
_cod_original_cell_volume        419.7041
_cod_original_formula_sum
;
H0.28 Ca0.012 Dy0.25 Fe0.018 Nb0.335 O6 Ta0.05 Th0.157 Ti1.605 U0.056 W0.014 
Y0.5
;
_cod_database_code               1531208
The preparation and crystal structure of a basic zirconium molybdate and its relationship to ion exchange gels
Clearfield, A.; Blessing, R.H.; Journal of Inorganic and Nuclear Chemistry 34 (1972) 2643–2663; doi:

data_4031507
_publ_section_title
;
 The preparation and crystal structure of a basic zirconium molybdate and
 its relationship to ion exchange gels
;
_journal_name_full               'Journal of Inorganic and Nuclear Chemistry'
_journal_page_first              2643
_journal_page_last               2663
_journal_volume                  34
_journal_year                    1972
_chemical_formula_sum            'H6 Mo2 O11 Zr'
_chemical_name_systematic        'Zr (Mo2 O7 (O H)2) (H2 O)2'
_space_group_IT_number           110
_symmetry_space_group_name_Hall  'I 4bw -2c'
_symmetry_space_group_name_H-M   'I 41 c d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   11.45
_cell_length_b                   11.45
_cell_length_c                   12.49
_cell_volume                     1637.470
_citation_journal_id_ASTM        JINCAO
_cod_data_source_file            Clearfield_JINCAO_1972_183.cif
_cod_data_source_block           H6Mo2O11Zr1
_cod_original_cell_volume        1637.47
_cod_original_formula_sum        'H6 Mo2 O11 Zr1'
_cod_database_code               4031507