LMucko/crystallography-open-database huggingface dataset:
An investigation of the low oxidation state chemistry of rhenium in the Ba O - Re - Re2 O7 phase diagram
Cheetham, A.K.; Thomas, D.M.; Journal of Solid State Chemistry 71 (1987) 61–69; doi:

data_1529756
_publ_section_title
;
 An investigation of the low oxidation state chemistry of rhenium in the
 Ba O - Re - Re2 O7 phase diagram
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              61
_journal_page_last               69
_journal_volume                  71
_journal_year                    1987
_chemical_formula_sum            'Ba2 O5 Re'
_chemical_name_systematic        'Ba2 Re O5'
_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                   7.3233
_cell_length_b                   5.7745
_cell_length_c                   11.4124
_cell_volume                     482.612
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Cheetham_JSSCBI_1987_1490.cif
_cod_data_source_block           Ba2O5Re1
_cod_original_cell_volume        482.6121
_cod_original_formula_sum        'Ba2 O5 Re1'
_cod_database_code               1529756
Low-temperature crystal and molecular structure of tetracarbonyl (2-bromoheptahydrotriborato(1-)) manganese (C O)4 Mn B3 H7 Br and a 1H NMR study of the kinetics of its intramolecular hydrogen exchange in solution
Chen, M.W.; Calabrese, J.C.; Gaines, D.F.; Hillenbrand, D.F.; Journal of the American Chemical Society 102 (1980) 4928–4933; doi:

data_4124421
_publ_section_title
;
 Low-temperature crystal and molecular structure of tetracarbonyl
 (2-bromoheptahydrotriborato(1-)) manganese (C O)4 Mn B3 H7 Br and a 1H
 NMR study of the kinetics of its intramolecular hydrogen exchange in
 solution
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              4928
_journal_page_last               4933
_journal_volume                  102
_journal_year                    1980
_chemical_formula_sum            'C4 H7 B3 Br Mn O4'
_chemical_name_systematic        '(C O)4 Mn B3 H7 Br'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2n 2a'
_symmetry_space_group_name_H-M   'P m c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.658
_cell_length_b                   9.084
_cell_length_c                   15.426
_cell_volume                     1073.114
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Chen_JACSAT_1980_580.cif
_cod_data_source_block           C4H7B3Br1Mn1O4
_cod_original_sg_symbol_Hall     '-P 2ac 2n (y,z,x)'
_cod_original_formula_sum        'C4 H7 B3 Br1 Mn1 O4'
_cod_database_code               4124421
Structural characterization and ionic conductivity of Co2+ stabilized beta" -alumina
Chen, S.; White, D.R.; Sato, H.; Robinson, W.R.; Lewis, J.B.; Journal of Solid State Chemistry 62 (1986) 26–34; doi:

data_1529757
_publ_section_title
;
 Structural characterization and ionic conductivity of Co2+ stabilized
 beta" -alumina
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              26
_journal_page_last               34
_journal_volume                  62
_journal_year                    1986
_chemical_formula_sum            'Al10.2 Co0.701 Na1.82 O16.9'
_chemical_name_systematic        'Na1.82 Al10.2 Co.701 O16.9'
_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            3
_cell_length_a                   5.6153
_cell_length_b                   5.6153
_cell_length_c                   33.7119
_cell_volume                     920.576
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Chen_JSSCBI_1986_1125.cif
_cod_data_source_block           Al10.2Co0.701Na1.82O16.9
_cod_original_cell_volume        920.5763
_cod_database_code               1529757
Crystal structure of Bi2 Mo2 O9: A selective oxidation catalyst
Chen, H.-Y.; Sleight, A.W.; Journal of Solid State Chemistry 63 (1986) 70–75; doi:

data_1529758
_publ_section_title
;
 Crystal structure of Bi2 Mo2 O9: A selective oxidation catalyst
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              70
_journal_page_last               75
_journal_volume                  63
_journal_year                    1986
_chemical_formula_sum            'Bi2 Mo2 O9'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.13
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   11.972
_cell_length_b                   10.813
_cell_length_c                   11.899
_cell_volume                     1540.360
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Chen_JSSCBI_1986_1128.cif
_cod_data_source_block           Bi2Mo2O9
_cod_original_cell_volume        1540.36
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_database_code               1529758
A New Mo5+ Phosphate with a Tunnel Structure: gamma Cs Mo2 P3 O13
Chen, J.J.; Lii, K.-H.; Wang, S.-L.; Journal of Solid State Chemistry 76 (1988) 204–209; doi:

data_1529759
_publ_section_title
;
 A New Mo5+ Phosphate with a Tunnel Structure: gamma Cs Mo2 P3 O13
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              204
_journal_page_last               209
_journal_volume                  76
_journal_year                    1988
_chemical_formula_sum            'Cs Mo2 O13 P3'
_chemical_name_systematic        'Cs (Mo2 P3 O13)'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                83.083
_cell_angle_beta                 97.42
_cell_angle_gamma                108.3
_cell_formula_units_Z            2
_cell_length_a                   6.342
_cell_length_b                   9.676
_cell_length_c                   10.0349
_cell_volume                     577.664
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Chen_JSSCBI_1988_1645.cif
_cod_data_source_block           Cs1Mo2O13P3
_cod_original_cell_volume        577.6636
_cod_original_formula_sum        'Cs1 Mo2 O13 P3'
_cod_database_code               1529759
The structure of Sn Mo6 S8 and the superconducting properties of the series Snx Mo6 S8 and My Snx Mo6 S8 (M = La, Ce, Pr, Eu, Gd, Ho, Lu, Y, In, U)
Chevrel, R.; Rossel, C.; Sergent, M.; Journal of the Less-Common Metals 72 (1980) 31–43; doi:

data_1529760
_publ_section_title
;
 The structure of Sn Mo6 S8 and the superconducting properties of the
 series Snx Mo6 S8 and My Snx Mo6 S8 (M = La, Ce, Pr, Eu, Gd, Ho, Lu, Y,
 In, U)
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              31
_journal_page_last               43
_journal_volume                  72
_journal_year                    1980
_chemical_formula_sum            'Mo6 S8 Sn'
_chemical_name_systematic        'Sn Mo6 S8'
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-P 3*'
_symmetry_space_group_name_H-M   'R -3 :R'
_cell_angle_alpha                89.7
_cell_angle_beta                 89.7
_cell_angle_gamma                89.7
_cell_formula_units_Z            1
_cell_length_a                   6.527
_cell_length_b                   6.527
_cell_length_c                   6.527
_cell_volume                     278.050
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Chevrel_JCOMAH_1980_576.cif
_cod_data_source_block           Mo6S8Sn1
_cod_original_cell_volume        278.0501
_cod_original_sg_symbol_Hall     '-R 3 (-y+z,x+z,-x+y+z)'
_cod_original_formula_sum        'Mo6 S8 Sn1'
_cod_database_code               1529760
Structure of crystals of the bisulfate (Cs2 S O4)3 Gd2 (S O4)3
Chibiskova, N.T.; Palkina, K.K.; Storozhenko, D.A.; Maksimova, N.V.; Skorikov, V.M.; Shevchuk, V.G.; Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 20 (1984) 1944–1946; doi:

data_1529761
_publ_section_title
;
 Structure of crystals of the bisulfate (Cs2 S O4)3 Gd2 (S O4)3
;
_journal_name_full
'Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy'
_journal_page_first              1944
_journal_page_last               1946
_journal_volume                  20
_journal_year                    1984
_chemical_formula_sum            'Cs6 Gd2 O24 S6'
_chemical_name_systematic        '(Cs2 S O4)3 Gd2 (S O4)3'
_space_group_IT_number           9
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.83
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   27.333
_cell_length_b                   10.139
_cell_length_c                   10.099
_cell_volume                     2678.854
_citation_journal_id_ASTM        IVNMAW
_cod_data_source_file            Chibiskova_IVNMAW_1984_1112.cif
_cod_data_source_block           Cs6Gd2O24S6
_cod_database_code               1529761
The crystal structure of Na Nd Si O4
Chichagov, A.V.; Belov, N.V.; Geokhimiya 1968 (1968) 1456–1461; doi:

data_1529762
_publ_section_title
;
 The crystal structure of Na Nd Si O4
;
_journal_name_full               Geokhimiya
_journal_page_first              1456
_journal_page_last               1461
_journal_volume                  1968
_journal_year                    1968
_chemical_formula_sum            'Na Nd O4 Si'
_chemical_name_systematic        'Na Nd Si O4'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   20
_cell_length_b                   9.28
_cell_length_c                   5.45
_cell_volume                     1011.520
_citation_journal_id_ASTM        GEOKAQ
_cod_data_source_file            Chichagov_GEOKAQ_1968_1775.cif
_cod_data_source_block           Na1Nd1O4Si1
_cod_original_cell_volume        1011.52
_cod_original_formula_sum        'Na1 Nd1 O4 Si1'
_cod_database_code               1529762
Synthesis and structure of dichlorobis(thiosemicarbazide) Mercury(II)
Chieh, C.; Canadian Journal of Chemistry 55 (1977) 1583–1587; doi:

data_1529763
_publ_section_title
;
 Synthesis and structure of dichlorobis(thiosemicarbazide) Mercury(II)
;
_journal_name_full               'Canadian Journal of Chemistry'
_journal_page_first              1583
_journal_page_last               1587
_journal_volume                  55
_journal_year                    1977
_chemical_formula_sum            'C2 H10 Cl2 Hg N6 S2'
_chemical_name_systematic        'Hg Cl2 (C H5 N3 S)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                   8.675
_cell_length_b                   8.123
_cell_length_c                   15.786
_cell_volume                     1112.392
_citation_journal_id_ASTM        CJCHAG
_cod_data_source_file            Chieh_CJCHAG_1977_106.cif
_cod_data_source_block           C2H10Cl2Hg1N6S2
_cod_original_cell_volume        1112.393
_cod_original_formula_sum        'C2 H10 Cl2 Hg1 N6 S2'
_cod_database_code               1529763
Synthesis and crystal structure of thiosemicarbazidedichloromercury(II)
Chieh, C.; Cowell, H.; Canadian Journal of Chemistry 55 (1977) 3898–3900; doi:

data_1529764
_publ_section_title
;
 Synthesis and crystal structure of thiosemicarbazidedichloromercury(II)
;
_journal_name_full               'Canadian Journal of Chemistry'
_journal_page_first              3898
_journal_page_last               3900
_journal_volume                  55
_journal_year                    1977
_chemical_formula_sum            'C H5 Cl2 Hg N3 S'
_chemical_name_systematic        '(S (C N H2) N H N H2) Hg Cl2'
_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                 100.3
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.966
_cell_length_b                   6.817
_cell_length_c                   12.092
_cell_volume                     727.168
_citation_journal_id_ASTM        CJCHAG
_cod_data_source_file            Chieh_CJCHAG_1977_614.cif
_cod_data_source_block           C1H5Cl2Hg1N3S1
_cod_original_cell_volume        727.1675
_cod_original_formula_sum        'C1 H5 Cl2 Hg1 N3 S1'
_cod_database_code               1529764
Thiosemicarbazide complexes of mercury(II) halides
Chieh, C.; Lee, L.P.C.; Chiu, C.; Canadian Journal of Chemistry 56 (1978) 2526–2529; doi:

data_1529765
_publ_section_title
;
 Thiosemicarbazide complexes of mercury(II) halides
;
_journal_name_full               'Canadian Journal of Chemistry'
_journal_page_first              2526
_journal_page_last               2529
_journal_volume                  56
_journal_year                    1978
_chemical_formula_sum            'C2 H10 Br2 Hg N6 S2'
_chemical_name_systematic        '(S C N H2 N H N H2)2 Hg Br2'
_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                   8.825
_cell_length_b                   8.587
_cell_length_c                   15.939
_cell_volume                     1207.862
_citation_journal_id_ASTM        CJCHAG
_cod_data_source_file            Chieh_CJCHAG_1978_235.cif
_cod_data_source_block           C2H10Br2Hg1N6S2
_cod_original_formula_sum        'C2 H10 Br2 Hg1 N6 S2'
_cod_database_code               1529765
A Structural Study of the Sodium (V) Uranate, Na U O3, by Time-of-Flight Powder Neutron Diffraction
Chippindale, A.M.; Harrison, W.T.A.; Dickens, P.G.; Journal of Solid State Chemistry 78 (1989) 256–261; doi:

data_1529766
_publ_section_title
;
 A Structural Study of the Sodium (V) Uranate, Na U O3, by Time-of-Flight
 Powder Neutron Diffraction
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              256
_journal_page_last               261
_journal_volume                  78
_journal_year                    1989
_chemical_formula_sum            'Na O3 U'
_chemical_name_systematic        'Na U O3'
_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            4
_cell_length_a                   5.779
_cell_length_b                   5.907
_cell_length_c                   8.283
_cell_volume                     282.753
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Chippindale_JSSCBI_1989_1786.cif
_cod_data_source_block           Na1O3U1
_cod_original_cell_volume        282.7531
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_original_formula_sum        'Na1 O3 U1'
_cod_database_code               1529766
Crystal structure of canasite Ca5 Na4 K2 (Si12 O30) ((O H), F)4
Chiragov, M.I.; Belov, N.V.; Mamedov, H.S.; Doklady Akademii Nauk SSSR 185 (1969) 672–674; doi:

data_1529767
_publ_section_title
;
 Crystal structure of canasite Ca5 Na4 K2 (Si12 O30) ((O H), F)4
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              672
_journal_page_last               674
_journal_volume                  185
_journal_year                    1969
_chemical_formula_sum            'Ca5 H4 K2 Na4 O34 Si12'
_chemical_name_systematic        'Ca5 Na4 K2 (Si12 O30) (O H)4'
_space_group_IT_number           8
_symmetry_space_group_name_Hall  'C -2y'
_symmetry_space_group_name_H-M   'C 1 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 112
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   18.74
_cell_length_b                   7.19
_cell_length_c                   12.33
_cell_volume                     1540.378
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Chiragov_DANKAS_1969_744.cif
_cod_data_source_block           H4Ca5K2Na4O34Si12
_cod_original_formula_sum        'H4 Ca5 K2 Na4 O34 Si12'
_cod_database_code               1529767
Reactions of the tetrasulfur pentanitride(-1)ion with halogens. Synthesis, spectroscopic characterization, and crystal structure of pentasulfur hexanitride
Chivers, T.; Proctor, J.; Canadian Journal of Chemistry 57 (1979) 1286–1293; doi:

data_1529768
_publ_section_title
;
 Reactions of the tetrasulfur pentanitride(-1)ion with halogens.
 Synthesis, spectroscopic characterization, and crystal structure of
 pentasulfur hexanitride
;
_journal_name_full               'Canadian Journal of Chemistry'
_journal_page_first              1286
_journal_page_last               1293
_journal_volume                  57
_journal_year                    1979
_chemical_formula_sum            'N6 S5'
_chemical_name_systematic        'S5 N6'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.46
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.787
_cell_length_b                   11.19
_cell_length_c                   7.427
_cell_volume                     700.343
_citation_journal_id_ASTM        CJCHAG
_cod_data_source_file            Chivers_CJCHAG_1979_369.cif
_cod_data_source_block           N6S5
_cod_database_code               1529768
The crystal structure of Na La (S O4)2
Chizhov, S.M.; Pokrovskii, A.N.; Kovba, L.M.; Kristallografiya 26 (1981) 834–836; doi:

data_1529769
_publ_section_title
;
 The crystal structure of Na La (S O4)2
;
_journal_name_full               Kristallografiya
_journal_page_first              834
_journal_page_last               836
_journal_volume                  26
_journal_year                    1981
_chemical_formula_sum            'La Na O8 S2'
_chemical_name_systematic        'Na La (S O4)2'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                102.25
_cell_angle_beta                 91.2
_cell_angle_gamma                76.71
_cell_formula_units_Z            2
_cell_length_a                   7.081
_cell_length_b                   6.765
_cell_length_c                   6.465
_cell_volume                     294.410
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Chizhov_KRISAJ_1981_1970.cif
_cod_data_source_block           La1Na1O8S2
_cod_original_cell_volume        294.4101
_cod_original_formula_sum        'La1 Na1 O8 S2'
_cod_database_code               1529769
A room-temperature neutron-diffraction study of Na H2 P O4
Choudhary, R.N.P.; Nelmes, R.J.; Rouse, K.D.; Chemical Physics Letters 78 (1981) 102–105; doi:

data_8000213
_publ_section_title
;
 A room-temperature neutron-diffraction study of Na H2 P O4
;
_journal_name_full               'Chemical Physics Letters'
_journal_page_first              102
_journal_page_last               105
_journal_volume                  78
_journal_year                    1981
_chemical_formula_sum            'H2 Na O4 P'
_chemical_name_systematic        'Na H2 P O4'
_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                 92.88
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   6.808
_cell_length_b                   13.491
_cell_length_c                   7.331
_cell_volume                     672.478
_citation_journal_id_ASTM        CHPLBC
_cod_data_source_file            Choudhary_CHPLBC_1981_617.cif
_cod_data_source_block           H2Na1O4P1
_cod_original_cell_volume        672.4779
_cod_original_formula_sum        'H2 Na1 O4 P1'
_cod_database_code               8000213
The structure of silver dicyanonitromethanide, Ag C (C N) 2 N O2
Chow, Y.M.; Britton, D.; Acta Crystallographica B (24,1968-38,1982) 30 (1974) 147–151; doi:

data_2106664
_publ_section_title
;
 The structure of silver dicyanonitromethanide, Ag C (C N) 2 N O2
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              147
_journal_page_last               151
_journal_volume                  30
_journal_year                    1974
_chemical_formula_sum            'C3 Ag N3 O2'
_chemical_name_systematic        'Ag C (C N)2 N O2'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 116.69
_cell_angle_gamma                90
_cell_formula_units_Z            32
_cell_length_a                   29.571
_cell_length_b                   7.818
_cell_length_c                   19.581
_cell_volume                     4044.517
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Chow_ACBCAR_1974_1429.cif
_cod_data_source_block           C3Ag1N3O2
_cod_original_formula_sum        'C3 Ag1 N3 O2'
_cod_database_code               2106664
The (Fe4 (N O)4 (mue-S)4)n series (n=0,-1) which possesses a cubanelike Fe4 S4 core: direct evidence for the antibonding tetrametal character of the unpaired electron upon a one-electron reduction of a completely bonding tetrahedral metal cluster
Chu, C.T.-W.; Lo, F.Y.K.; Dahl, L.F.; Journal of the American Chemical Society 104 (1982) 3409–3422; doi:

data_4124422
_publ_section_title
;
 The (Fe4 (N O)4 (mue-S)4)n series (n=0,-1) which possesses a cubanelike
 Fe4 S4 core: direct evidence for the antibonding tetrametal character of
 the unpaired electron upon a one-electron reduction of a completely
 bonding tetrahedral metal cluster
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              3409
_journal_page_last               3422
_journal_volume                  104
_journal_year                    1982
_chemical_formula_sum            'Fe4 N4 O4 S4'
_chemical_name_systematic        'Fe4 (N O)4 S4'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 103.66
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.35
_cell_length_b                   9.627
_cell_length_c                   10.407
_cell_volume                     1202.325
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Chu_JACSAT_1982_767.cif
_cod_data_source_block           Fe4N4O4S4
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_database_code               4124422