LMucko/crystallography-open-database huggingface dataset:
Crystal structure and physicochemical properties of Sr B12 H12 (H2 O)7
Solntsev, K.A.; Kuznetsov, N.T.; Rannev, N.V.; Zavodnik, V.E.; Doklady Akademii Nauk SSSR 232 (1977) 1366–1369; doi:

data_1530805
_publ_section_title
;
 Crystal structure and physicochemical properties of Sr B12 H12 (H2 O)7
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              1366
_journal_page_last               1369
_journal_volume                  232
_journal_year                    1977
_chemical_formula_sum            'B12 H26 O7 Sr'
_chemical_name_systematic        'Sr (B12 H12) (H2 O)7'
_space_group_IT_number           146
_symmetry_space_group_name_Hall  'P 3*'
_symmetry_space_group_name_H-M   'R 3 :R'
_cell_angle_alpha                83.4
_cell_angle_beta                 83.4
_cell_angle_gamma                83.4
_cell_formula_units_Z            1
_cell_length_a                   7.594
_cell_length_b                   7.594
_cell_length_c                   7.594
_cell_volume                     429.849
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Solntsev_DANKAS_1977_117.cif
_cod_data_source_block           H26B12O7Sr1
_cod_original_cell_volume        429.8493
_cod_original_sg_symbol_Hall     'R 3 (-y+z,x+z,-x+y+z)'
_cod_original_formula_sum        'H26 B12 O7 Sr1'
_cod_database_code               1530805
Structure and properties of (K2 B12 H10 F2) (H2 O)
Solntsev, K.A.; Zukova, N.A.; Butman, L.A.; Kuznetsov, N.T.; Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 16 (1980) 1882–1884; doi:

data_1530806
_publ_section_title
;
 Structure and properties of (K2 B12 H10 F2) (H2 O)
;
_journal_name_full
'Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy'
_journal_page_first              1882
_journal_page_last               1884
_journal_volume                  16
_journal_year                    1980
_chemical_formula_sum            'B12 F2 H12 K2 O'
_chemical_name_systematic        '(K2 B12 H10 F2) (H2 O)'
_space_group_IT_number           56
_symmetry_space_group_name_Hall  '-P 2ab 2ac'
_symmetry_space_group_name_H-M   'P c c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.992
_cell_length_b                   11.424
_cell_length_c                   13.407
_cell_volume                     1224.067
_citation_journal_id_ASTM        IVNMAW
_cod_data_source_file            Solntsev_IVNMAW_1980_702.cif
_cod_data_source_block           H12B12F2K2O1
_cod_original_formula_sum        'H12 B12 F2 K2 O1'
_cod_database_code               1530806
The crystal structure of guanido iodate C (N H2)3 I O3
Sorokina, N.I.; Ilyukhin, V.V.; Belov, N.V.; Doklady Akademii Nauk SSSR 236 (1977) 1361–1363; doi:

data_1530807
_publ_section_title
;
 The crystal structure of guanido iodate C (N H2)3 I O3
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              1361
_journal_page_last               1363
_journal_volume                  236
_journal_year                    1977
_chemical_formula_sum            'C H6 I N3 O3'
_chemical_name_systematic        'C (N H2)3 I O3'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2n'
_symmetry_space_group_name_H-M   'P 1 1 21/n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                96.12
_cell_formula_units_Z            8
_cell_length_a                   7.374
_cell_length_b                   10.281
_cell_length_c                   15.763
_cell_volume                     1188.215
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Sorokina_DANKAS_1977_260.cif
_cod_data_source_block           C1H6I1N3O3
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2016-12-29
;
_cod_original_sg_symbol_Hall     '-P 2ybc (z,x-z,y)'
_cod_original_formula_sum        'C1 H6 I1 N3 O3'
_cod_database_code               1530807
About the crystal structure of sodium iodate
Sorokina, N.I.; Ilyukhin, V.V.; Pakhomov, V.I.; Belov, N.V.; Doklady Akademii Nauk SSSR 249 (1979) 613–616; doi:

data_1530808
_publ_section_title
;
 About the crystal structure of sodium iodate
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              613
_journal_page_last               616
_journal_volume                  249
_journal_year                    1979
_chemical_formula_sum            'I Na O3'
_chemical_name_systematic        'Na I O3'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2ab'
_symmetry_space_group_name_H-M   'P b n 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.3959
_cell_length_b                   5.7475
_cell_length_c                   8.1286
_cell_volume                     298.811
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Sorokina_DANKAS_1979_1095.cif
_cod_data_source_block           I1Na1O3
_cod_original_cell_volume        298.8109
_cod_original_sg_symbol_Hall     'P 2c -2n (y,-x,z)'
_cod_original_formula_sum        'I1 Na1 O3'
_cod_database_code               1530808
Crystal structure of Mg (I O3)2 (H2 O)4
Sorokina, N.I.; Vinogradov, E.E.; Ilyukhin, V.V.; Belov, N.V.; Doklady Akademii Nauk SSSR 247 (1979) 106–109; doi:

data_1530809
_publ_section_title
;
 Crystal structure of Mg (I O3)2 (H2 O)4
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              106
_journal_page_last               109
_journal_volume                  247
_journal_year                    1979
_chemical_formula_sum            'H8 I2 Mg O10'
_chemical_name_systematic        'Mg (I O3)2 (H2 O)4'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2bc'
_symmetry_space_group_name_H-M   'P 1 1 21/b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                100.36
_cell_formula_units_Z            2
_cell_length_a                   8.321
_cell_length_b                   8.501
_cell_length_c                   6.636
_cell_volume                     461.757
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Sorokina_DANKAS_1979_469.cif
_cod_data_source_block           H8I2Mg1O10
_cod_original_cell_volume        461.7569
_cod_original_sg_symbol_Hall     '-P 2ybc (-x,z,y)'
_cod_original_formula_sum        'H8 I2 Mg1 O10'
_cod_database_code               1530809
The crystal structure of aluminium iodate octahydrate
Sorokina, N.I.; Ilyukhin, V.V.; Kalinin, V.R.; Belov, N.V.; Doklady Akademii Nauk SSSR 247 (1979) 360–363; doi:

data_1530810
_publ_section_title
;
 The crystal structure of aluminium iodate octahydrate
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              360
_journal_page_last               363
_journal_volume                  247
_journal_year                    1979
_chemical_formula_sum            'Al H16 I3 O17'
_chemical_name_systematic        'Al (I O3)3 (H2 O)8'
_space_group_IT_number           1
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                89.93
_cell_angle_beta                 87.62
_cell_angle_gamma                63.58
_cell_formula_units_Z            2
_cell_length_a                   7.473
_cell_length_b                   8.392
_cell_length_c                   13.574
_cell_volume                     761.563
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Sorokina_DANKAS_1979_470.cif
_cod_data_source_block           H16Al1I3O17
_cod_original_cell_volume        761.5629
_cod_original_formula_sum        'H16 Al1 I3 O17'
_cod_database_code               1530810
Redetermination of the crystal structure of Na3 Sc2 (P O4)3
Sotofte, I.; Fu, D.C.; Solid State Ionics 26 (1988) 307–310; doi:

data_1530811
_publ_section_title
;
 Redetermination of the crystal structure of Na3 Sc2 (P O4)3
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              307
_journal_page_last               310
_journal_volume                  26
_journal_year                    1988
_chemical_formula_sum            'Na2.63 O12 P3 Sc2'
_chemical_name_systematic        'Na2.63 Sc2 (P O4)3'
_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                 126.01
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.709
_cell_length_b                   8.936
_cell_length_c                   9.024
_cell_volume                     1024.692
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Sotofte_SSIOD3_1988_1748.cif
_cod_data_source_block           Na2.63O12P3Sc2
_cod_database_code               1530811
Redetermination of the crystal structure of Na3 Sc2 (P O4)3
Sotofte, I.; Fu, D.C.; Solid State Ionics 26 (1988) 307–310; doi:

data_1530812
_publ_section_title
;
 Redetermination of the crystal structure of Na3 Sc2 (P O4)3
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              307
_journal_page_last               310
_journal_volume                  26
_journal_year                    1988
_chemical_formula_sum            'Na4 O12 P3 Sc2'
_chemical_name_systematic        'Na4 Sc2 (P O4)3'
_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                 124.74
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.464
_cell_length_b                   8.936
_cell_length_c                   9.024
_cell_volume                     1024.712
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Sotofte_SSIOD3_1988_1749.cif
_cod_data_source_block           Na4O12P3Sc2
_cod_database_code               1530812
Redetermination of the Crystal Structure of Na3 Sc2 (P O4)3
Sotofte, I.; Fu, D.C.; Solid State Ionics 26 (1988) 307–310; doi:

data_1530813
_publ_section_title
;
 Redetermination of the Crystal Structure of Na3 Sc2 (P O4)3
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              307
_journal_page_last               310
_journal_volume                  26
_journal_year                    1988
_chemical_formula_sum            'Na1.2 O12 P3 Sc2'
_chemical_name_systematic        'Na1.2 Sc2 (P O4)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                   8.93
_cell_length_b                   8.93
_cell_length_c                   22.245
_cell_volume                     1536.264
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Sotofte_SSIOD3_1988_1750.cif
_cod_data_source_block           Na1.2O12P3Sc2
_cod_original_cell_volume        1536.265
_cod_database_code               1530813
Synthesis and crystal structure of a peroxo-bridged binuclear Rhodium(III) complex and its superoxo-bridged analogue
Springborg, J.; Zehnder, M.; Helvetica Chimica Acta 67 (1984) 2218–2225; doi:

data_1530814
_publ_section_title
;
 Synthesis and crystal structure of a peroxo-bridged binuclear
 Rhodium(III) complex and its superoxo-bridged analogue
;
_journal_name_full               'Helvetica Chimica Acta'
_journal_page_first              2218
_journal_page_last               2225
_journal_volume                  67
_journal_year                    1984
_chemical_formula_sum            'Cl3 H24 N7 O16 Rh2'
_chemical_name_systematic
'(N H3)4 Rh (O H) (O2) Rh (N H3)3 (H2 O) (Cl O4)3'
_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                 107.17
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.269
_cell_length_b                   10.769
_cell_length_c                   15.964
_cell_volume                     2015.239
_citation_journal_id_ASTM        HCACAV
_cod_data_source_file            Springborg_HCACAV_1984_1089.cif
_cod_data_source_block           H24Cl3N7O16Rh2
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'H24 Cl3 N7 O16 Rh2'
_cod_database_code               1530814
Synthesis and crystal structure of a peroxo-bridged binuclear Rhodium(III) complex and its superoxo-bridged analogue
Springborg, J.; Zehnder, M.; Helvetica Chimica Acta 67 (1984) 2218–2225; doi:

data_1530815
_publ_section_title
;
 Synthesis and crystal structure of a peroxo-bridged binuclear
 Rhodium(III) complex and its superoxo-bridged analogue
;
_journal_name_full               'Helvetica Chimica Acta'
_journal_page_first              2218
_journal_page_last               2225
_journal_volume                  67
_journal_year                    1984
_chemical_formula_sum            'H24 N11 O16 Rh2'
_chemical_name_systematic
'(N H3)4 Rh (O H) (O2) Rh (N H3)3 (H2 O) (N O3)4'
_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            4
_cell_length_a                   14.997
_cell_length_b                   11.952
_cell_length_c                   10.489
_cell_volume                     1880.092
_citation_journal_id_ASTM        HCACAV
_cod_data_source_file            Springborg_HCACAV_1984_1090.cif
_cod_data_source_block           H24N11O16Rh2
_cod_database_code               1530815
Some substitutional chemistry in known ternary and quaternary chalcogenides
Squattrito, P.J.; Sunshine, S.A.; Ibers, J.A.; Journal of Solid State Chemistry 64 (1986) 261–269; doi:

data_1530816
_publ_section_title
;
 Some substitutional chemistry in known ternary and quaternary
 chalcogenides
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              261
_journal_page_last               269
_journal_volume                  64
_journal_year                    1986
_chemical_formula_sum            'Ni3 S8 Ta2'
_chemical_name_systematic        'Ta2 Ni3 S8'
_space_group_IT_number           55
_symmetry_space_group_name_Hall  '-P 2 2ab'
_symmetry_space_group_name_H-M   'P b a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   14.092
_cell_length_b                   10.078
_cell_length_c                   3.314
_cell_volume                     470.652
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Squattrito_JSSCBI_1986_1262.cif
_cod_data_source_block           Ni3S8Ta2
_cod_original_cell_volume        470.6516
_cod_database_code               1530816
Some substitutional chemistry in known ternary and quaternary chalcogenides
Squattrito, P.J.; Ibers, J.A.; Sunshine, S.A.; Journal of Solid State Chemistry 64 (1986) 261–269; doi:

data_1530817
_publ_section_title
;
 Some substitutional chemistry in known ternary and quaternary
 chalcogenides
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              261
_journal_page_last               269
_journal_volume                  64
_journal_year                    1986
_chemical_formula_sum            'Pd0.89 S5 Ta2'
_chemical_name_systematic        'Ta2 Pd.89 S5'
_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                 104.48
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.204
_cell_length_b                   3.269
_cell_length_c                   15.183
_cell_volume                     586.483
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Squattrito_JSSCBI_1986_1263.cif
_cod_data_source_block           Pd0.89S5Ta2
_cod_original_cell_volume        586.4831
_cod_database_code               1530817
Sodium and oxygen disorder in a scandium-substituted Nasicon: A time-of-flight neutron powder diffraction study of Na2.5 Zr1.8 Sc0.2 Si1.3 P1.7 O12
Squattrito, P.J.; Volin, K.; Rudolf, P.R.; Hinson, P.G.; Clearfield, A.; Jorgensen, J.D.; Solid State Ionics 31 (1988) 31–40; doi:

data_1530818
_publ_section_title
;
 Sodium and oxygen disorder in a scandium-substituted Nasicon: A
 time-of-flight neutron powder diffraction study of Na2.5 Zr1.8 Sc0.2
 Si1.3 P1.7 O12
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              31
_journal_page_last               40
_journal_volume                  31
_journal_year                    1988
_chemical_formula_sum            'Na2.49 O12 P1.71 Sc0.2 Si1.29 Zr1.8'
_chemical_name_systematic        'Na2.49 (Zr1.8 Sc0.2) (Si O4)1.29 (P O4)1.71'
_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                   8.9834
_cell_length_b                   8.9834
_cell_length_c                   22.8658
_cell_volume                     1598.080
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Squattrito_SSIOD3_1988_1686.cif
_cod_data_source_block           Na2.49O12P1.71Sc0.2Si1.29Zr1.8
_cod_original_cell_volume        1598.08
_cod_database_code               1530818
Sodium and oxygen disorder in a scandium-substituted Nasicon: A time-of-flight neutron powder diffraction study of Na2.5 Zr1.8 Sc0.2 Si1.3 P1.7 O12
Squattrito, P.J.; Rudolf, P.R.; Jorgensen, J.D.; Clearfield, A.; Hinson, P.G.; Volin, K.; Solid State Ionics 31 (1988) 31–40; doi:

data_1530819
_publ_section_title
;
 Sodium and oxygen disorder in a scandium-substituted Nasicon: A
 time-of-flight neutron powder diffraction study of Na2.5 Zr1.8 Sc0.2
 Si1.3 P1.7 O12
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              31
_journal_page_last               40
_journal_volume                  31
_journal_year                    1988
_chemical_formula_sum            'Na2.5 O12 P1.7 Sc0.2 Si1.3 Zr1.8'
_chemical_name_systematic        'Na2.5 Zr1.8 Sc0.2 Si1.3 P1.7 O12'
_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                   8.9863
_cell_length_b                   8.9863
_cell_length_c                   23.0161
_cell_volume                     1609.623
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Squattrito_SSIOD3_1988_1687.cif
_cod_data_source_block           Na2.5O12P1.7Sc0.2Si1.3Zr1.8
_cod_database_code               1530819
High-pressure neutron diffraction study of Si2 N2 O
Srinivasa, S.R.; Jorgensen, J.D.; Cartz, L.; Worlton, T.G.; Beyerlein, R.A.; Billy, M.; Journal of Applied Crystallography 10 (1977) 167–171; doi:

data_2300529
_publ_section_title
;
 High-pressure neutron diffraction study of Si2 N2 O
;
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              167
_journal_page_last               171
_journal_volume                  10
_journal_year                    1977
_chemical_formula_sum            'N2 O Si2'
_chemical_name_systematic        'Si2 N2 O'
_space_group_IT_number           36
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.847
_cell_length_b                   5.452
_cell_length_c                   4.824
_cell_volume                     232.680
_citation_journal_id_ASTM        JACGAR
_cod_data_source_file            Srinivasa_JACGAR_1977_264.cif
_cod_data_source_block           N2O1Si2
_cod_original_cell_volume        232.6801
_cod_original_formula_sum        'N2 O1 Si2'
_cod_database_code               2300529
A neutron diffraction study of hydrogen positions at 13 K, domain model, and chemical composition of staurolite
Stahl, K.; Kvick, A.; Smith, J.V.; Journal of Solid State Chemistry 73 (1988) 362–380; doi:

data_1530820
_publ_section_title
;
 A neutron diffraction study of hydrogen positions at 13 K, domain model,
 and chemical composition of staurolite
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              362
_journal_page_last               380
_journal_volume                  73
_journal_year                    1988
_chemical_formula_sum
'Al17.6 Fe3.05 H3.64 Mg0.86 O48 Si7.68 Ti0.15'
_chemical_name_systematic
'Mg0.86 Fe3.05 Ti0.15 H3.64 Al17.6 Si7.68 O48'
_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                 90.015
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   7.8639
_cell_length_b                   16.625
_cell_length_c                   5.651
_cell_volume                     738.797
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Stahl_JSSCBI_1988_1643.cif
_cod_data_source_block           H3.64Al17.6Fe3.05Mg0.86O48Si7.68Ti0.15
_cod_original_cell_volume        738.7967
_cod_original_formula_sum
'H3.64 Al17.6 Fe3.05 Mg0.86 O48 Si7.68 Ti0.15'
_cod_database_code               1530820
The radiographical analysis of the solid solution in system Bi-Sb-Te
Stasova, M.M.; Abrikosov, N.Kh.; Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 6 (1970) 1090–1094; doi:

data_1530821
_publ_section_title
;
 The radiographical analysis of the solid solution in system Bi-Sb-Te
;
_journal_name_full
'Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy'
_journal_page_first              1090
_journal_page_last               1094
_journal_volume                  6
_journal_year                    1970
_chemical_formula_sum            'Bi Sb Te3'
_chemical_name_systematic        '(Bi0.5 Sb0.5)2 Te3'
_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                   4.33
_cell_length_b                   4.33
_cell_length_c                   30.4
_cell_volume                     493.606
_citation_journal_id_ASTM        IVNMAW
_cod_data_source_file            Stasova_IVNMAW_1970_512.cif
_cod_data_source_block           Bi1Sb1Te3
_cod_original_cell_volume        493.6055
_cod_original_formula_sum        'Bi1 Sb1 Te3'
_cod_database_code               1530821