LMucko/crystallography-open-database huggingface dataset:
Multiple Li positions inside oxygen octahedra in lithiated Ti O2 anatase
Wagemaker, M.; Kearley, G.J.; van Well, A.A.; Mutka, H.; Mulder, F.M.; Journal of the American Chemical Society 125 (2003) 840–848; doi:

data_4124519
_publ_section_title
;
 Multiple Li positions inside oxygen octahedra in lithiated Ti O2 anatase
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              840
_journal_page_last               848
_journal_volume                  125
_journal_year                    2003
_chemical_formula_sum            'Li0.51 O2 Ti'
_chemical_name_systematic        'Li0.51 Ti O2'
_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_formula_units_Z            4
_cell_length_a                   3.8186
_cell_length_b                   4.0842
_cell_length_c                   9.0656
_cell_volume                     141.386
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Wagemaker_JACSAT_2003_1844.cif
_cod_data_source_block           Li0.51O2Ti1
_cod_original_cell_volume        141.3864
_cod_original_formula_sum        'Li0.51 O2 Ti1'
_cod_database_code               4124519
Structure and properties of nonstoichiometric mixed perovskites A3 B'1+x B"2-x O9-d
Tao, S.-W.; Irvine, J.T.S.; Solid State Ionics 154 (2002) 659–667; doi:

data_1532222
_publ_section_title
;
 Structure and properties of nonstoichiometric mixed perovskites A3 B'1+x
 B"2-x O9-d
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              659
_journal_page_last               667
_journal_volume                  154
_journal_year                    2002
_chemical_formula_sum            'Mn0.8 Nb1.2 O6 Sr2'
_chemical_name_systematic        'Sr2 (Mn0.8 Nb1.2) O6'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.6451
_cell_length_b                   5.6589
_cell_length_c                   7.9729
_cell_volume                     254.695
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Tao_SSIOD3_2002_873.cif
_cod_data_source_block           Mn0.8Nb1.2O6Sr2
_cod_original_cell_volume        254.6947
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_database_code               1532222
Crystalline intermetallic compounds in the K-Te system: the Zintl-Klemm principle revisited
Seifert-Lorenz, K.; Hafner, J.; Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 094105-1–094105-15; doi:

data_1532223
_publ_section_title
;
 Crystalline intermetallic compounds in the K-Te system: the Zintl-Klemm
 principle revisited
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              094105-1
_journal_page_last               094105-15
_journal_volume                  66
_journal_year                    2002
_chemical_formula_sum            'K2 Te2'
_space_group_IT_number           189
_symmetry_space_group_name_Hall  'P -6 -2'
_symmetry_space_group_name_H-M   'P -6 2 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   9.6637
_cell_length_b                   9.6637
_cell_length_c                   6.4781
_cell_volume                     523.920
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Seifert-Lorenz_PRBMDO_2002_1747.cif
_cod_data_source_block           K2Te2
_cod_original_cell_volume        523.9202
_cod_database_code               1532223
Multiple Li positions inside oxygen octahedra in lithiated Ti O2 anatase
Wagemaker, M.; Kearley, G.J.; van Well, A.A.; Mutka, H.; Mulder, F.M.; Journal of the American Chemical Society 125 (2003) 840–848; doi:

data_4124520
_publ_section_title
;
 Multiple Li positions inside oxygen octahedra in lithiated Ti O2 anatase
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              840
_journal_page_last               848
_journal_volume                  125
_journal_year                    2003
_chemical_formula_sum            'Li0.59 O2 Ti'
_chemical_name_systematic        'Li0.59 Ti O2'
_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_formula_units_Z            4
_cell_length_a                   3.8141
_cell_length_b                   4.0771
_cell_length_c                   9.042
_cell_volume                     140.607
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Wagemaker_JACSAT_2003_1845.cif
_cod_data_source_block           Li0.59O2Ti1
_cod_original_cell_volume        140.6073
_cod_original_formula_sum        'Li0.59 O2 Ti1'
_cod_database_code               4124520
Neutron diffraction study of the ordered structures of nonstoichiometric titanium carbide
Tashmetov, M.Yu.; Lee, J.-S.; Em, V.T.; Lee, C.H.; Choi, Y.-N.; Shim, H.-S.; Physik (Berlin) 311 (2002) 318–325; doi:

data_1532224
_publ_section_title
;
 Neutron diffraction study of the ordered structures of nonstoichiometric
 titanium carbide
;
_journal_name_full               'Physik (Berlin)'
_journal_page_first              318
_journal_page_last               325
_journal_volume                  311
_journal_year                    2002
_chemical_formula_sum            'C0.62 Ti'
_chemical_name_systematic        'Ti C0.62'
_space_group_IT_number           227
_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            32
_cell_length_a                   8.624
_cell_length_b                   8.624
_cell_length_c                   8.624
_cell_volume                     641.396
_citation_journal_id_ASTM        PHYBE3
_cod_data_source_file            Tashmetov_PHYBE3_2002_802.cif
_cod_data_source_block           C0.62Ti1
_cod_original_cell_volume        641.3959
_cod_original_formula_sum        'C0.62 Ti1'
_cod_database_code               1532224
Crystalline intermetallic compounds in the K-Te system: the Zintl-Klemm principle revisited
Seifert-Lorenz, K.; Hafner, J.; Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 094105-1–094105-15; doi:

data_1532225
_publ_section_title
;
 Crystalline intermetallic compounds in the K-Te system: the Zintl-Klemm
 principle revisited
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              094105-1
_journal_page_last               094105-15
_journal_volume                  66
_journal_year                    2002
_chemical_formula_sum            'K2 Te2'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   5.6543
_cell_length_b                   5.6543
_cell_length_c                   12.3386
_cell_volume                     341.629
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Seifert-Lorenz_PRBMDO_2002_1748.cif
_cod_data_source_block           K2Te2
_cod_original_cell_volume        341.6286
_cod_database_code               1532225
Formation of (Co Cl4 (H2 O)2)(2-) complex in (Co Cl2) * (Mg Cl2) * 8(H2 O) double salt: structural and energetic properties of (M Cl4 (H2 O)2)(2-) and (M (H2 O)6)(2+) (M = Mg, Co)
Waizumi, K.; Matsumoto, T.; Masuda, H.; Abe, T.; Fukushima, N.; Journal of Solid State Chemistry 174 (2003) 182–188; doi:

data_1532226
_publ_section_title
;
 Formation of (Co Cl4 (H2 O)2)(2-) complex in (Co Cl2) * (Mg Cl2) * 8(H2
 O) double salt: structural and energetic properties of (M Cl4 (H2
 O)2)(2-) and (M (H2 O)6)(2+) (M = Mg, Co)
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              182
_journal_page_last               188
_journal_volume                  174
_journal_year                    2003
_chemical_formula_sum            'Cl4 Co H16 Mg O8'
_chemical_name_systematic        '(Mg (H2 O)6) (Co Cl4 (H2 O)2)'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                81.99
_cell_angle_beta                 88.4
_cell_angle_gamma                84.61
_cell_formula_units_Z            1
_cell_length_a                   6.0976
_cell_length_b                   6.308
_cell_length_c                   8.579
_cell_volume                     325.279
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Waizumi_JSSCBI_2003_1625.cif
_cod_data_source_block           H16Cl4Co1Mg1O8
_cod_original_cell_volume        325.2788
_cod_original_formula_sum        'H16 Cl4 Co1 Mg1 O8'
_cod_database_code               1532226
Neutron diffraction study of the ordered structures of nonstoichiometric titanium carbide
Tashmetov, M.Yu.; Em, V.T.; Lee, J.-S.; Choi, Y.-N.; Lee, C.H.; Shim, H.-S.; Physik (Berlin) 311 (2002) 318–325; doi:

data_1532227
_publ_section_title
;
 Neutron diffraction study of the ordered structures of nonstoichiometric
 titanium carbide
;
_journal_name_full               'Physik (Berlin)'
_journal_page_first              318
_journal_page_last               325
_journal_volume                  311
_journal_year                    2002
_chemical_formula_sum            'C0.59 Ti'
_chemical_name_systematic        'Ti C0.59'
_space_group_IT_number           166
_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            6
_cell_length_a                   3.06094
_cell_length_b                   3.06094
_cell_length_c                   14.85575
_cell_volume                     120.541
_citation_journal_id_ASTM        PHYBE3
_cod_data_source_file            Tashmetov_PHYBE3_2002_803.cif
_cod_data_source_block           C0.59Ti1
_cod_original_formula_sum        'C0.59 Ti1'
_cod_database_code               1532227
Crystalline intermetallic compounds in the K-Te system: the Zintl-Klemm principle revisited
Seifert-Lorenz, K.; Hafner, J.; Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 094105-1–094105-15; doi:

data_1532228
_publ_section_title
;
 Crystalline intermetallic compounds in the K-Te system: the Zintl-Klemm
 principle revisited
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              094105-1
_journal_page_last               094105-15
_journal_volume                  66
_journal_year                    2002
_chemical_formula_sum            'K2 Te3'
_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                   15.952
_cell_length_b                   10.343
_cell_length_c                   4.645
_cell_volume                     766.386
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Seifert-Lorenz_PRBMDO_2002_1749.cif
_cod_data_source_block           K2Te3
_cod_original_cell_volume        766.3857
_cod_database_code               1532228
Crystal structures and magnetic properties of cobalt chalcogenides Ba La2 Co (S1-x Sex)5 (0.0 <= x <= 0.4)
Wakeshima, M.; Hinatsu, Y.; Ishii, Y.; Shimojo, Y.; Morii, Y.; Journal of Materials Chemistry 12 (2002) 631–634; doi:

data_7222220
_publ_section_title
;
 Crystal structures and magnetic properties of cobalt chalcogenides Ba La2
 Co (S1-x Sex)5 (0.0 <= x <= 0.4)
;
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              631
_journal_page_last               634
_journal_volume                  12
_journal_year                    2002
_chemical_formula_sum            'Ba Co La2 S5'
_chemical_name_systematic        'Ba La2 Co S5'
_space_group_IT_number           82
_symmetry_space_group_name_Hall  'I -4'
_symmetry_space_group_name_H-M   'I -4'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.9177
_cell_length_b                   7.9177
_cell_length_c                   13.5571
_cell_volume                     849.894
_citation_journal_id_ASTM        JMACEP
_cod_data_source_file            Wakeshima_JMACEP_2002_617.cif
_cod_data_source_block           Ba1Co1La2S5
_cod_original_cell_volume        849.8942
_cod_original_formula_sum        'Ba1 Co1 La2 S5'
_cod_database_code               7222220
Neutron scattering experiment on U3 Pd20 Si6. I. Crystal and magnetic structure
Tateiwa, N.; Metoki, N.; Aoki, H.; Koike, Y.; Kimura, N.; Komatsubara, T.; Oikawa, K.; Physik (Berlin) 312 (2002) 891–893; doi:

data_1532229
_publ_section_title
;
 Neutron scattering experiment on U3 Pd20 Si6. I. Crystal and magnetic
 structure
;
_journal_name_full               'Physik (Berlin)'
_journal_page_first              891
_journal_page_last               893
_journal_volume                  312
_journal_year                    2002
_chemical_formula_sum            'Pd20 Si6 U3'
_chemical_name_systematic        'U3 Pd20 Si6'
_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_formula_units_Z            4
_cell_length_a                   12.175
_cell_length_b                   12.175
_cell_length_c                   12.175
_cell_volume                     1804.708
_citation_journal_id_ASTM        PHYBE3
_cod_data_source_file            Tateiwa_PHYBE3_2002_804.cif
_cod_data_source_block           Pd20Si6U3
_cod_database_code               1532229
Crystalline intermetallic compounds in the K-Te system: the Zintl-Klemm principle revisited
Seifert-Lorenz, K.; Hafner, J.; Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 094105-1–094105-15; doi:

data_1532230
_publ_section_title
;
 Crystalline intermetallic compounds in the K-Te system: the Zintl-Klemm
 principle revisited
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              094105-1
_journal_page_last               094105-15
_journal_volume                  66
_journal_year                    2002
_chemical_formula_sum            'K5 Te3'
_space_group_IT_number           87
_symmetry_space_group_name_Hall  '-I 4'
_symmetry_space_group_name_H-M   'I 4/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.8611
_cell_length_b                   13.8611
_cell_length_c                   6.4468
_cell_volume                     1238.624
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Seifert-Lorenz_PRBMDO_2002_1750.cif
_cod_data_source_block           K5Te3
_cod_database_code               1532230
Die Kristallstruktur des Minerals Scholzit
Taxer, K.J.; Naturwissenschaften 58 (1971) 192–192; doi:

data_1532231
_publ_section_title
;
 Die Kristallstruktur des Minerals Scholzit
;
_journal_name_full               Naturwissenschaften
_journal_page_first              192
_journal_page_last               192
_journal_volume                  58
_journal_year                    1971
_chemical_formula_sum            'Ca H4 O10 P2 Zn2'
_chemical_name_systematic        'Ca Zn2 (P O4)2 (H2 O)2'
_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                   17.149
_cell_length_b                   7.412
_cell_length_c                   6.667
_cell_volume                     847.432
_citation_journal_id_ASTM        NATWAY
_cod_data_source_file            Taxer_NATWAY_1971_122.cif
_cod_data_source_block           H4Ca1O10P2Zn2
_cod_original_cell_volume        847.4316
_cod_original_formula_sum        'H4 Ca1 O10 P2 Zn2'
_cod_database_code               1532231
Ueber die Systeme Alkalimetallbromid/Mangan(II)-bromid
Seifert, H.J.; Dau, E.; Zeitschrift fuer Anorganische und Allgemeine Chemie 391 (1972) 302–312; doi:

data_1532232
_publ_section_title
;
 Ueber die Systeme Alkalimetallbromid/Mangan(II)-bromid
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              302
_journal_page_last               312
_journal_volume                  391
_journal_year                    1972
_chemical_formula_sum            'Br3 Cs Mn'
_chemical_name_systematic        'Cs Mn Br3'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   7.618
_cell_length_b                   7.618
_cell_length_c                   6.519
_cell_volume                     327.637
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Seifert_ZAACAB_1972_1911.cif
_cod_data_source_block           Br3Cs1Mn1
_cod_original_cell_volume        327.6375
_cod_original_formula_sum        'Br3 Cs1 Mn1'
_cod_database_code               1532232
Specific heat and neutron diffraction study on quaternary sulfides Ba Nd2 Co S5 and Ba Nd2 Zn S5
Wakeshima, M.; Yamaguchi, Y.; Taira, N.; Tobo, A.; Ohoyama, K.; Hinatsu, Y.; Journal of Solid State Chemistry 174 (2003) 159–164; doi:

data_1532233
_publ_section_title
;
 Specific heat and neutron diffraction study on quaternary sulfides Ba Nd2
 Co S5 and Ba Nd2 Zn S5
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              159
_journal_page_last               164
_journal_volume                  174
_journal_year                    2003
_chemical_formula_sum            'Ba Co Nd2 S5'
_chemical_name_systematic        'Ba Nd2 (Co S4) S'
_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                   7.7782
_cell_length_b                   7.7782
_cell_length_c                   13.5132
_cell_volume                     817.554
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Wakeshima_JSSCBI_2003_1621.cif
_cod_data_source_block           Ba1Co1Nd2S5
_cod_original_formula_sum        'Ba1 Co1 Nd2 S5'
_cod_database_code               1532233
Effect of Mo doping on the room-temperature structure of vanadium sesquioxide
Tenailleau, C.; Suard, E.; Rodriguez-Carvajal, J.; Crosnier-Lopez, M.P.; Lacorre, P.; Chemistry of Materials (1,1989-) 14 (2002) 3569–3575; doi:

data_4002537
_publ_section_title
;
 Effect of Mo doping on the room-temperature structure of vanadium
 sesquioxide
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              3569
_journal_page_last               3575
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'Mo0.04 O3 V1.96'
_chemical_name_systematic        '(V0.98 Mo0.02)2 O3'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   4.9508
_cell_length_b                   4.9508
_cell_length_c                   14.0316
_cell_volume                     297.844
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Tenailleau_CMATEX_2002_240.cif
_cod_data_source_block           Mo0.04O3V1.96
_cod_original_cell_volume        297.8438
_cod_database_code               4002537
Ueber die Systeme Alkalimetallbromid/Mangan(II)-bromid
Seifert, H.J.; Dau, E.; Zeitschrift fuer Anorganische und Allgemeine Chemie 391 (1972) 302–312; doi:

data_1532234
_publ_section_title
;
 Ueber die Systeme Alkalimetallbromid/Mangan(II)-bromid
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              302
_journal_page_last               312
_journal_volume                  391
_journal_year                    1972
_chemical_formula_sum            'Br3 Mn Rb'
_chemical_name_systematic        'Rb (Mn Br3)'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   7.462
_cell_length_b                   7.462
_cell_length_c                   6.543
_cell_volume                     315.514
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Seifert_ZAACAB_1972_1918.cif
_cod_data_source_block           Br3Mn1Rb1
_cod_original_cell_volume        315.5136
_cod_original_formula_sum        'Br3 Mn1 Rb1'
_cod_database_code               1532234
Structural characterization of neptunyl(VI) trinitrato complexes: M[NpO~2~(NO~3~)~3~] (M = NH~4~^+^ and K^+^)
Wang, Junhu; Kitazawa, Takafumi; Nakada, Masami; Yamashita, Toshiyuki; Takeda, Masuo; Bulletin of the Chemical Society of Japan 75 (2002) 253–257; doi:10.1246/bcsj.75.253

data_1532235
_publ_section_title
;
 Structural characterization of neptunyl(VI) trinitrato complexes:
 M[NpO~2~(NO~3~)~3~] (M = NH~4~^+^ and K^+^)
;
_journal_issue                   2
_journal_name_full               'Bulletin of the Chemical Society of Japan'
_journal_page_first              253
_journal_page_last               257
_journal_paper_doi               10.1246/bcsj.75.253
_journal_volume                  75
_journal_year                    2002
_chemical_formula_sum            'H4 N4 Np O11'
_chemical_name_systematic        '(N H4) (Np O2) (N O3)3'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   9.26
_cell_length_b                   9.26
_cell_length_c                   18.92
_cell_volume                     1404.992
_citation_journal_id_ASTM        BCSJA8
_cod_data_source_file            Wang_BCSJA8_2002_1111.cif
_cod_data_source_block           H4N4Np1O11
_cod_original_formula_sum        'H4 N4 Np1 O11'
_cod_database_code               1532235