LMucko/crystallography-open-database huggingface dataset:
Preparation and characterization of H Fe4 (B H2) (C O)12 A hydrogenated iron boron cluster
Wong, K.W.; Scheidt, W.R.; Fehlner, T.P.; Journal of the American Chemical Society 104 (1982) 1111–1113; doi:

data_4124473
_publ_section_title
;
 Preparation and characterization of H Fe4 (B H2) (C O)12 A hydrogenated
 iron boron cluster
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              1111
_journal_page_last               1113
_journal_volume                  104
_journal_year                    1982
_chemical_formula_sum            'C12 H3 B Fe4 O12'
_chemical_name_systematic        'H Fe4 (B H2) (C O)12'
_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                 94.32
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   16.429
_cell_length_b                   8.74
_cell_length_c                   13.237
_cell_volume                     1895.294
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Wong_JACSAT_1982_899.cif
_cod_data_source_block           C12H3B1Fe4O12
_cod_original_formula_sum        'C12 H3 B1 Fe4 O12'
_cod_database_code               4124473
The preparation and structure of the alpha- and beta-quartz polymorphs of beryllium fluoride
Wright, A.F.; Fitch, A.N.; Wright, A.C.; Journal of Solid State Chemistry 73 (1988) 298–304; doi:

data_1531002
_publ_section_title
;
 The preparation and structure of the alpha- and beta-quartz polymorphs of
 beryllium fluoride
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              298
_journal_page_last               304
_journal_volume                  73
_journal_year                    1988
_chemical_formula_sum            'Be F2'
_space_group_IT_number           180
_symmetry_space_group_name_Hall  'P 62 2 (0 0 4)'
_symmetry_space_group_name_H-M   'P 62 2 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   4.806
_cell_length_b                   4.806
_cell_length_c                   5.2404
_cell_volume                     104.824
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Wright_JSSCBI_1988_1660.cif
_cod_data_source_block           Be1F2
_cod_original_cell_volume        104.8245
_cod_original_sg_symbol_Hall     'P 62 2 (x,y,z+1/3)'
_cod_original_formula_sum        'Be1 F2'
_cod_database_code               1531002
The crystal structure of a synthetic variety of alluaudite Na2 (Fe(3+))0.5 (Fe(2+))0.5)2 (Fe(2+)) (P O4)3
Yakubovich, O.V.; Egorov-Tismenko, Yu.K.; Simonov, M.A.; Belov, N.V.; Doklady Akademii Nauk SSSR 236 (1977) 1123–1126; doi:

data_1531003
_publ_section_title
;
 The crystal structure of a synthetic variety of alluaudite Na2
 (Fe(3+))0.5 (Fe(2+))0.5)2 (Fe(2+)) (P O4)3
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              1123
_journal_page_last               1126
_journal_volume                  236
_journal_year                    1977
_chemical_formula_sum            'Fe3 Na2 O12 P3'
_chemical_name_systematic        'Na2 Fe3 (P O4)3'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-I 2a'
_symmetry_space_group_name_H-M   'I 1 1 2/a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.923
_cell_length_b                   6.5
_cell_length_c                   12.538
_cell_volume                     890.192
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Yakubovich_DANKAS_1977_259.cif
_cod_data_source_block           Fe3Na2O12P3
_cod_original_cell_volume        890.1918
_cod_original_sg_symbol_Hall     '-C 2yc (-x+z,x,y)'
_cod_database_code               1531003
Structures of langbeinite-type K2 Mn2 (S O4)3 in cubic and orthorhombic phases
Yamada, N.; Maeda, M.; Adachi, H.; Journal of the Physical Society of Japan 50 (1981) 907–913; doi:

data_1531004
_publ_section_title
;
 Structures of langbeinite-type K2 Mn2 (S O4)3 in cubic and orthorhombic
 phases
;
_journal_name_full               'Journal of the Physical Society of Japan'
_journal_page_first              907
_journal_page_last               913
_journal_volume                  50
_journal_year                    1981
_chemical_formula_sum            'K2 Mn2 O12 S3'
_chemical_name_systematic        'K2 Mn2 (S O4)3'
_space_group_IT_number           19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.081
_cell_length_b                   10.108
_cell_length_c                   10.048
_cell_volume                     1023.879
_citation_journal_id_ASTM        JUPSAU
_cod_data_source_file            Yamada_JUPSAU_1981_627.cif
_cod_data_source_block           K2Mn2O12S3
_cod_database_code               1531004
A Structural Study of the Incommensurate-to-Ferroelectric Phase Transition in K2 Se O4
Yamada, N.; Ono, Y.; Ikeda, T.; Journal of the Physical Society of Japan 53 (1984) 2565–2574; doi:

data_1531005
_publ_section_title
;
 A Structural Study of the Incommensurate-to-Ferroelectric Phase
 Transition in K2 Se O4
;
_journal_name_full               'Journal of the Physical Society of Japan'
_journal_page_first              2565
_journal_page_last               2574
_journal_volume                  53
_journal_year                    1984
_chemical_formula_sum            'K2 O4 Se'
_chemical_name_systematic        'K2 (Se 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                   22.716
_cell_length_b                   10.339
_cell_length_c                   5.967
_cell_volume                     1401.414
_citation_journal_id_ASTM        JUPSAU
_cod_data_source_file            Yamada_JUPSAU_1984_1232.cif
_cod_data_source_block           K2O4Se1
_cod_original_formula_sum        'K2 O4 Se1'
_cod_database_code               1531005
Crystal-chemical characterization of K Al Si3 O8 with the hollandite structure
Yamada, H.; Matsui, Y.; Ito, E.; Mineralogical Journal (Japan) 12 (1984) 29–34; doi:

data_1531006
_publ_section_title
;
 Crystal-chemical characterization of K Al Si3 O8 with the hollandite
 structure
;
_journal_name_full               'Mineralogical Journal (Japan)'
_journal_page_first              29
_journal_page_last               34
_journal_volume                  12
_journal_year                    1984
_chemical_formula_sum            'Al K O8 Si3'
_chemical_name_systematic        'K Al Si3 O8'
_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            2
_cell_length_a                   9.3244
_cell_length_b                   9.3244
_cell_length_c                   2.7227
_cell_volume                     236.724
_citation_journal_id_ASTM        MJTOAS
_cod_data_source_file            Yamada_MJTOAS_1984_1014.cif
_cod_data_source_block           Al1K1O8Si3
_cod_original_cell_volume        236.7236
_cod_original_formula_sum        'Al1 K1 O8 Si3'
_cod_database_code               1531006
Mo5 O14 - twinning and three-dimensional structure, determined from a partly tantalum-substituted crystal
Yamazoe, N.; Kihlborg, L.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 1666–1672; doi:

data_2106744
_publ_section_title
;
 Mo5 O14 - twinning and three-dimensional structure, determined from a
 partly tantalum-substituted crystal
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1666
_journal_page_last               1672
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Mo4.65 O14 Ta0.35'
_chemical_name_systematic        '(Mo0.93 Ta0.07)5 O14'
_space_group_IT_number           29
_symmetry_space_group_name_Hall  'P -2a -2ab'
_symmetry_space_group_name_H-M   'P b 21 a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   45.75
_cell_length_b                   22.87
_cell_length_c                   4.0023
_cell_volume                     4187.616
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Yamazoe_ACBCAR_1975_749.cif
_cod_data_source_block           Mo4.65O14Ta0.35
_cod_original_sg_symbol_Hall     'P 2c -2ac (-x,z,y)'
_cod_database_code               2106744
The crystal structure of the compounds R6 Ga21 Co7 (R= Sm, Gd, Tb, Dy, Ho, Er, Tm, Lu, Y)
Yarmolyuk, Ya.P.; Gladyshevskii, R.E.; Grin', Yu.; Doklady Akademii Nauk SSSR 260 (1981) 1139–1142; doi:

data_1531007
_publ_section_title
;
 The crystal structure of the compounds R6 Ga21 Co7 (R= Sm, Gd, Tb, Dy,
 Ho, Er, Tm, Lu, Y)
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              1139
_journal_page_last               1142
_journal_volume                  260
_journal_year                    1981
_chemical_formula_sum            'Co7 Ga21 Ho6'
_chemical_name_systematic        'Ho6 Ga21 Co7'
_space_group_IT_number           127
_symmetry_space_group_name_Hall  '-P 4 2ab'
_symmetry_space_group_name_H-M   'P 4/m b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   16.687
_cell_length_b                   16.687
_cell_length_c                   4.134
_cell_volume                     1151.137
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Yarmolyuk_DANKAS_1981_1614.cif
_cod_data_source_block           Co7Ga21Ho6
_cod_database_code               1531007
Crystal structure of R3 Ni6 Ga2 (R= Pr, Nd, Sm, Gd, Tb, Dy, Ho, Er, Tm, Y)
Yarmolyuk, Ya.P.; Grin', Yu.; Gladyshevskii, E.I.; Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Matematichni Ta Tekhnichni Nauki 40 (1978) 759–763; doi:

data_1531008
_publ_section_title
;
 Crystal structure of R3 Ni6 Ga2 (R= Pr, Nd, Sm, Gd, Tb, Dy, Ho, Er, Tm,
 Y)
;
_journal_name_full
;
Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Matematichni Ta 
Tekhnichni Nauki
;
_journal_page_first              759
_journal_page_last               763
_journal_volume                  40
_journal_year                    1978
_chemical_formula_sum            'Ga2 Ni6 Sm3'
_chemical_name_systematic        'Sm3 Ni6 Ga2'
_space_group_IT_number           229
_symmetry_space_group_name_Hall  '-I 4 2 3'
_symmetry_space_group_name_H-M   'I m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.978
_cell_length_b                   8.978
_cell_length_c                   8.978
_cell_volume                     723.667
_citation_journal_id_ASTM        DNUNDU
_cod_data_source_file            Yarmolyuk_DNUNDU_1978_168.cif
_cod_data_source_block           Ga2Ni6Sm3
_cod_database_code               1531008
Crystal structure of Hf3 Ni2 Si3
Yarmolyuk, Ya.P.; Grin', Yu.; Gladyshevskii, E.I.; Kristallografiya 22 (1977) 726–730; doi:

data_1531009
_publ_section_title
;
 Crystal structure of Hf3 Ni2 Si3
;
_journal_name_full               Kristallografiya
_journal_page_first              726
_journal_page_last               730
_journal_volume                  22
_journal_year                    1977
_chemical_formula_sum            'Hf3 Ni2 Si3'
_space_group_IT_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            4
_cell_length_a                   3.831
_cell_length_b                   9.862
_cell_length_c                   13.003
_cell_volume                     491.271
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Yarmolyuk_KRISAJ_1977_161.cif
_cod_data_source_block           Hf3Ni2Si3
_cod_original_cell_volume        491.2706
_cod_database_code               1531009
Crystal structures of hydrides (deuterides) based on intermetallic compounds Zr V T (T= Fe, Cu, Nb) with structures of Mg Zn2 type
Yartys', V.A.; Semenenko, K.N.; Burnasheva, V.V.; Zhurnal Neorganicheskoi Khimii 29 (1984) 615–621; doi:

data_1531010
_publ_section_title
;
 Crystal structures of hydrides (deuterides) based on intermetallic
 compounds Zr V T (T= Fe, Cu, Nb) with structures of Mg Zn2 type
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              615
_journal_page_last               621
_journal_volume                  29
_journal_year                    1984
_chemical_formula_sum            'D3.6 Fe V Zr'
_chemical_name_systematic        'Zr V Fe D3.6'
_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            4
_cell_length_a                   5.431
_cell_length_b                   5.431
_cell_length_c                   8.863
_cell_volume                     226.397
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Yartys_ZNOKAQ_1984_1055.cif
_cod_data_source_block           D3.6Fe1V1Zr1
_cod_original_cell_volume        226.3972
_cod_original_formula_sum        'D3.6 Fe1 V1 Zr1'
_cod_database_code               1531010
Crystal structures of hydrides (deuterides) based on intermetallic compounds Zr V T (T= Fe, Cu, Nb) with structures of Mg Zn2 type
Yartys', V.A.; Semenenko, K.N.; Burnasheva, V.V.; Zhurnal Neorganicheskoi Khimii 29 (1984) 615–621; doi:

data_1531011
_publ_section_title
;
 Crystal structures of hydrides (deuterides) based on intermetallic
 compounds Zr V T (T= Fe, Cu, Nb) with structures of Mg Zn2 type
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              615
_journal_page_last               621
_journal_volume                  29
_journal_year                    1984
_chemical_formula_sum            'Cu D4 V Zr'
_chemical_name_systematic        'Zr V Cu D4'
_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            4
_cell_length_a                   5.468
_cell_length_b                   5.468
_cell_length_c                   8.94
_cell_volume                     231.486
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Yartys_ZNOKAQ_1984_1056.cif
_cod_data_source_block           D4Cu1V1Zr1
_cod_original_cell_volume        231.4862
_cod_original_formula_sum        'D4 Cu1 V1 Zr1'
_cod_database_code               1531011
Crystal structures of hydrides (deuterides) based on intermetallic compounds Zr V T (T=Fe,Cu,Nb) with structures of Mg Zn2 type
Yartys', V.A.; Burnasheva, V.V.; Semenenko, K.N.; Zhurnal Neorganicheskoi Khimii 29 (1984) 615–621; doi:

data_1531012
_publ_section_title
;
 Crystal structures of hydrides (deuterides) based on intermetallic
 compounds Zr V T (T=Fe,Cu,Nb) with structures of Mg Zn2 type
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              615
_journal_page_last               621
_journal_volume                  29
_journal_year                    1984
_chemical_formula_sum            'D5.7 Nb V Zr'
_chemical_name_systematic        'Zr V Nb D5.7'
_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            4
_cell_length_a                   5.69
_cell_length_b                   5.69
_cell_length_c                   9.288
_cell_volume                     260.422
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Yartys_ZNOKAQ_1984_1057.cif
_cod_data_source_block           D5.7Nb1V1Zr1
_cod_original_cell_volume        260.4218
_cod_original_formula_sum        'D5.7 Nb1 V1 Zr1'
_cod_database_code               1531012
Structure of Sr4 Fe6 O13, a new perovskite-derivative in the Sr-Fe-O system
Yoshiasa, A.; Ueno, K.; Horiuchi, H.; Kanamaru, F.; Materials Research Bulletin 21 (1986) 175–181; doi:

data_1531013
_publ_section_title
;
 Structure of Sr4 Fe6 O13, a new perovskite-derivative in the Sr-Fe-O
 system
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              175
_journal_page_last               181
_journal_volume                  21
_journal_year                    1986
_chemical_formula_sum            'Fe6 O13 Sr4'
_chemical_name_systematic        'Sr4 (Fe6 O13)'
_space_group_IT_number           45
_symmetry_space_group_name_Hall  'I 2 -2c'
_symmetry_space_group_name_H-M   'I b a 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.103
_cell_length_b                   18.924
_cell_length_c                   5.572
_cell_volume                     1170.751
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Yoshiasa_MRBUAC_1986_1247.cif
_cod_data_source_block           Fe6O13Sr4
_cod_database_code               1531013
A structural investigation of deuterated ammonium titanium sulfide ((N D4)+)0.22 (N D3)0.34 Ti S2- by time-of-flight neutron powder diffraction
Young, V.G.jr.; McKelvy, M.J.; von Dreele, R.B.; Glaunsinger, W.S.; Solid State Ionics 26 (1988) 47–54; doi:

data_1531014
_publ_section_title
;
 A structural investigation of deuterated ammonium titanium sulfide ((N
 D4)+)0.22 (N D3)0.34 Ti S2- by time-of-flight neutron powder diffraction
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              47
_journal_page_last               54
_journal_volume                  26
_journal_year                    1988
_chemical_formula_sum            'D1.9 N0.56 S2 Ti'
_chemical_name_systematic        '(N D4)0.22 (N D3)0.34 Ti S2'
_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                   3.4022
_cell_length_b                   3.4022
_cell_length_c                   26.433
_cell_volume                     264.970
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Young_SSIOD3_1988_1764.cif
_cod_data_source_block           D1.9N0.56S2Ti1
_cod_original_cell_volume        264.97
_cod_original_formula_sum        'D1.9 N0.56 S2 Ti1'
_cod_database_code               1531014
The quaternary compound Ce3 Mn Cu8 Al24 and its crystal structure
Zarechnyuk, O.S.; Kripyakevich, P.I.; Kolobnev, I.F.; Cherkashin, E.E.; Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 3 (1967) 182–183; doi:

data_1531015
_publ_section_title
;
 The quaternary compound Ce3 Mn Cu8 Al24 and its crystal structure
;
_journal_name_full
'Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy'
_journal_page_first              182
_journal_page_last               183
_journal_volume                  3
_journal_year                    1967
_chemical_formula_sum            'Al24 Ce3 Cu8 Mn'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   8.38
_cell_length_b                   8.38
_cell_length_c                   8.38
_cell_volume                     588.480
_citation_journal_id_ASTM        IVNMAW
_cod_data_source_file            Zarechnyuk_IVNMAW_1967_1917.cif
_cod_data_source_block           Al24Ce3Cu8Mn1
_cod_original_cell_volume        588.4805
_cod_original_formula_sum        'Al24 Ce3 Cu8 Mn1'
_cod_database_code               1531015
The new modification of lead dioxide and the texture of anode sediments
Zaslavskii, A.I.; Kondrashev, Yu.D.; Tolkachev, S.S.; Doklady Akademii Nauk SSSR 75 (1950) 559–561; doi:

data_1531016
_publ_section_title
;
 The new modification of lead dioxide and the texture of anode sediments
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              559
_journal_page_last               561
_journal_volume                  75
_journal_year                    1950
_chemical_formula_sum            'O2 Pb'
_chemical_name_systematic        'Pb O2'
_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                   4.948
_cell_length_b                   5.951
_cell_length_c                   5.497
_cell_volume                     161.862
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Zaslavskii_DANKAS_1950_1976.cif
_cod_data_source_block           O2Pb1
_cod_original_cell_volume        161.8622
_cod_original_formula_sum        'O2 Pb1'
_cod_database_code               1531016
The structure of new antiferromagnetic Bi Fe O3
Zaslavskii, A.I.; Tutov, A.G.; Doklady Akademii Nauk SSSR 135 (1960) 815–817; doi:

data_1531017
_publ_section_title
;
 The structure of new antiferromagnetic Bi Fe O3
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              815
_journal_page_last               817
_journal_volume                  135
_journal_year                    1960
_chemical_formula_sum            'Bi Fe O3'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-P 3* 2'
_symmetry_space_group_name_H-M   'R -3 m :R'
_cell_angle_alpha                89.6
_cell_angle_beta                 89.6
_cell_angle_gamma                89.6
_cell_formula_units_Z            1
_cell_length_a                   3.952
_cell_length_b                   3.952
_cell_length_c                   3.952
_cell_volume                     61.719
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Zaslavskii_DANKAS_1960_1984.cif
_cod_data_source_block           Bi1Fe1O3
_cod_original_cell_volume        61.71904
_cod_original_sg_symbol_Hall     '-R 3 2" (-y+z,x+z,-x+y+z)'
_cod_original_formula_sum        'Bi1 Fe1 O3'
_cod_database_code               1531017