LMucko/crystallography-open-database huggingface dataset:
New ternary compounds Sc3 B0.75 C3, Sc2 B1.1 C3.2, Sc B15 C1.60 and subsolidus phase relations in the Sc - B - C system at 1700 C
Shi, Y.; Leithe-Jasper, A.; Tanaka, T.; Journal of Solid State Chemistry 148 (1999) 250–259; doi:

data_1521920
_publ_section_title
;
 New ternary compounds Sc3 B0.75 C3, Sc2 B1.1 C3.2, Sc B15 C1.60 and
 subsolidus phase relations in the Sc - B - C system at 1700 C
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              250
_journal_page_last               259
_journal_volume                  148
_journal_year                    1999
_chemical_formula_sum            'C2 B Sc2'
_chemical_name_systematic        'Sc2 B C2'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.3259
_cell_length_b                   3.3259
_cell_length_c                   10.6741
_cell_volume                     118.073
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Shi_JSSCBI_1999_386.cif
_cod_data_source_block           C2B1Sc2
_cod_original_cell_volume        118.0727
_cod_original_formula_sum        'C2 B1 Sc2'
_cod_database_code               1521920
Sc2 B1.1 C3.2, a new rare-earth boron carbide with graphite-like layers
Shi, Y.; Tanaka, T.; Leithe-Jasper, A.; Bando, Y.; Bourgeois, L.; Journal of Solid State Chemistry 148 (1999) 442–449; doi:

data_1521921
_publ_section_title
;
 Sc2 B1.1 C3.2, a new rare-earth boron carbide with graphite-like layers
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              442
_journal_page_last               449
_journal_volume                  148
_journal_year                    1999
_chemical_formula_sum            'C157 B54 Sc98'
_chemical_name_systematic        'Sc98 B54 C157'
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   23.71
_cell_length_b                   23.71
_cell_length_c                   6.703
_cell_volume                     3263.345
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Shi_JSSCBI_1999_413.cif
_cod_data_source_block           C157B54Sc98
_cod_original_cell_volume        3263.344
_cod_database_code               1521921
Crystal structure and ionic conductivity of a new sodium magnesium titanium oxide
Shilov, G.V.; Atovmyan, L.O.; Volochaev, V.A.; Nalbadyan, V.B.; Kristallografiya 44 (1999) 1029–1033; doi:

data_1521922
_publ_section_title
;
 Crystal structure and ionic conductivity of a new sodium magnesium
 titanium oxide
;
_journal_name_full               Kristallografiya
_journal_page_first              1029
_journal_page_last               1033
_journal_volume                  44
_journal_year                    1999
_chemical_formula_sum            'Mg0.7 Na5.42 O18 Ti7.3'
_chemical_name_systematic        'Na5.42 (Mg0.7 Ti7.3) O18'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-B 2'
_symmetry_space_group_name_H-M   'B 1 1 2/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                76.4
_cell_formula_units_Z            2
_cell_length_a                   23.063
_cell_length_b                   10.689
_cell_length_c                   2.944
_cell_volume                     705.407
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Shilov_KRISAJ_1999_435.cif
_cod_data_source_block           Mg0.7Na5.42O18Ti7.3
_cod_original_cell_volume        705.4066
_cod_original_sg_symbol_Hall     '-C 2y (-x,z,y)'
_cod_database_code               1521922
Crystal structures of Sr Bi2 Ta2 O9 and Sr0.8 Bi2.2 Ta2 O9 ferroelectric materials
Shimakawa, Y.; Nakagawa, Y.; Kubo, Y.; Kamiyama, T.; Asano, H.; Materials Research Society Symposia Proceedings 541 (1999) 523–528; doi:

data_1521923
_publ_section_title
;
 Crystal structures of Sr Bi2 Ta2 O9 and Sr0.8 Bi2.2 Ta2 O9 ferroelectric
 materials
;
_journal_name_full
'Materials Research Society Symposia Proceedings'
_journal_page_first              523
_journal_page_last               528
_journal_volume                  541
_journal_year                    1999
_chemical_formula_sum            'Bi2 O9 Sr Ta2'
_chemical_name_systematic        'Sr Bi2 (Ta2 O9)'
_space_group_IT_number           36
_symmetry_space_group_name_Hall  'A -2 2a'
_symmetry_space_group_name_H-M   'A 21 a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.52237
_cell_length_b                   5.52408
_cell_length_c                   25.0264
_cell_volume                     763.456
_citation_journal_id_ASTM        MRSPDH
_cod_data_source_file            Shimakawa_MRSPDH_1999_544.cif
_cod_data_source_block           Bi2O9Sr1Ta2
_cod_original_cell_volume        763.4556
_cod_original_sg_symbol_Hall     'C 2c -2 (z,y,-x)'
_cod_original_formula_sum        'Bi2 O9 Sr1 Ta2'
_cod_database_code               1521923
Synthesis of the delafossite-type Cu In O2
Shimode, M.; Sasaki, M.; Mukaida, K.; Journal of Solid State Chemistry 151 (2000) 16–20; doi:

data_1521924
_publ_section_title
;
 Synthesis of the delafossite-type Cu In O2
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              16
_journal_page_last               20
_journal_volume                  151
_journal_year                    2000
_chemical_formula_sum            'Cu In O2'
_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                   3.2922
_cell_length_b                   3.2922
_cell_length_c                   17.388
_cell_volume                     163.212
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Shimode_JSSCBI_2000_1847.cif
_cod_data_source_block           Cu1In1O2
_cod_original_cell_volume        163.2122
_cod_original_formula_sum        'Cu1 In1 O2'
_cod_database_code               1521924
Crystal structure of La (Mg2/3 Nb1/3) O3 ceramics
Shin, D.M.; Cho, B.J.; Nahm, S.; Paik, J.H.; Kim, K.Y.; Byun Jae Dong; Yoop Hakoechi (Journal of the Korean Ceramic Society) 36 (1999) 848–852; doi:

data_1521925
_publ_section_title
;
 Crystal structure of La (Mg2/3 Nb1/3) O3 ceramics
;
_journal_name_full
'Yoop Hakoechi (Journal of the Korean Ceramic Society)'
_journal_page_first              848
_journal_page_last               852
_journal_volume                  36
_journal_year                    1999
_chemical_formula_sum            'La Mg0.598 Nb0.402 O3'
_chemical_name_systematic        'La (Mg0.598 Nb0.402) O3'
_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                 89.982
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.6004
_cell_length_b                   5.6414
_cell_length_c                   7.9346
_cell_volume                     250.687
_citation_journal_id_ASTM        YPHJAP
_cod_data_source_file            Shin_YPHJAP_1999_776.cif
_cod_data_source_block           La1Mg0.598Nb0.402O3
_cod_original_cell_volume        250.6865
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'La1 Mg0.598 Nb0.402 O3'
_cod_database_code               1521925
Crystal growth and X-ray structure determination of Rb3 Bi2 I9
Sidey, V.I.; Voroshilov, Yu.V.; Kun, S.V.; Peresh, E.Yu.; Journal of Alloys Compd. 296 (2000) 53–58; doi:

data_1521926
_publ_section_title
;
 Crystal growth and X-ray structure determination of Rb3 Bi2 I9
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              53
_journal_page_last               58
_journal_volume                  296
_journal_year                    2000
_chemical_formula_sum            'Bi2 I9 Rb3'
_chemical_name_systematic        'Rb3 (Bi2 I9)'
_space_group_IT_number           7
_symmetry_space_group_name_Hall  'P -2yc'
_symmetry_space_group_name_H-M   'P 1 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 125.39
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   14.69
_cell_length_b                   8.195
_cell_length_c                   25.645
_cell_volume                     2516.825
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Sidey_JALCEU_2000_1189.cif
_cod_data_source_block           Bi2I9Rb3
_cod_database_code               1521926
Structural effects of impurities in Ba4 Er2 Cu7 O15-d: incorporation of Au and of Al
Siegrist, T.; Waszczak, J.V.; van Dover, R.B.; Schneemeyer, L.F.; Journal of Solid State Chemistry 150 (2000) 228–232; doi:

data_1521927
_publ_section_title
;
 Structural effects of impurities in Ba4 Er2 Cu7 O15-d: incorporation of
 Au and of Al
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              228
_journal_page_last               232
_journal_volume                  150
_journal_year                    2000
_chemical_formula_sum            'Al0.42 Ba4 Cu6.58 Er2 O14.88'
_chemical_name_systematic        'Ba4 Er2 Cu6.58 Al0.42 O14.88'
_space_group_IT_number           65
_symmetry_space_group_name_Hall  '-A 2 2'
_symmetry_space_group_name_H-M   'A m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.8526
_cell_length_b                   3.8746
_cell_length_c                   50.41049
_cell_volume                     752.492
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Siegrist_JSSCBI_2000_1784.cif
_cod_data_source_block           Al0.42Ba4Cu6.58Er2O14.88
_cod_original_cell_volume        752.4917
_cod_original_sg_symbol_Hall     '-C 2 2 (z,x,y)'
_cod_database_code               1521927
Sm4 S3 (Si2 O7) und Na Sm9 S2 (Si O4)6 : zwei Sulfidsilicate mit dreiwertigem Samarium
Sieke, C.; Schleid, T.; Zeitschrift fuer Anorganische und Allgemeine Chemie 625 (1999) 131–136; doi:

data_1521928
_publ_section_title
;
 Sm4 S3 (Si2 O7) und Na Sm9 S2 (Si O4)6 : zwei Sulfidsilicate mit
 dreiwertigem Samarium
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              131
_journal_page_last               136
_journal_volume                  625
_journal_year                    1999
_chemical_formula_sum            'O7 S3 Si2 Sm4'
_chemical_name_systematic        'Sm4 S3 (Si2 O7)'
_space_group_IT_number           141
_symmetry_space_group_name_Hall  '-I 4bd 2'
_symmetry_space_group_name_H-M   'I 41/a m d :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   11.864
_cell_length_b                   11.864
_cell_length_c                   13.87
_cell_volume                     1952.265
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Sieke_ZAACAB_1999_796.cif
_cod_data_source_block           O7S3Si2Sm4
_cod_database_code               1521928
Sm4 S3 (Si2 O7) und Na Sm9 S2 (Si O4)6 : zwei Sulfidsilicate mit dreiwertigem Samarium
Sieke, C.; Schleid, T.; Zeitschrift fuer Anorganische und Allgemeine Chemie 625 (1999) 131–136; doi:

data_1521929
_publ_section_title
;
 Sm4 S3 (Si2 O7) und Na Sm9 S2 (Si O4)6 : zwei Sulfidsilicate mit
 dreiwertigem Samarium
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              131
_journal_page_last               136
_journal_volume                  625
_journal_year                    1999
_chemical_formula_sum            'Na O24 S2 Si6 Sm9'
_chemical_name_systematic        'Na Sm9 S2 (Si O4)6'
_space_group_IT_number           176
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   9.7532
_cell_length_b                   9.7532
_cell_length_c                   6.7646
_cell_volume                     557.272
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Sieke_ZAACAB_1999_797.cif
_cod_data_source_block           Na1O24S2Si6Sm9
_cod_original_cell_volume        557.2717
_cod_original_formula_sum        'Na1 O24 S2 Si6 Sm9'
_cod_database_code               1521929
Sm3 Cl (Si O4)2 : ein chlorarmes Chloridorthosilicat des Samariums
Sieke, C.; Schleid, T.; Zeitschrift fuer Anorganische und Allgemeine Chemie 625 (1999) 377–378; doi:

data_1521930
_publ_section_title
;
 Sm3 Cl (Si O4)2 : ein chlorarmes Chloridorthosilicat des Samariums
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              377
_journal_page_last               378
_journal_volume                  625
_journal_year                    1999
_chemical_formula_sum            'Cl O8 Si2 Sm3'
_chemical_name_systematic        'Sm3 Cl (Si O4)2'
_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                   7.0174
_cell_length_b                   18.008
_cell_length_c                   6.2663
_cell_volume                     791.868
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Sieke_ZAACAB_1999_870.cif
_cod_data_source_block           Cl1O8Si2Sm3
_cod_original_cell_volume        791.8682
_cod_original_formula_sum        'Cl1 O8 Si2 Sm3'
_cod_database_code               1521930
Structure cristalline de sulfates doubles de sodium et de terres rares
Sirotinkin, S.P.; Tchijov, S.M.; Kovba, L.M.; Pokrovskii, A.N.; Journal of the Less-Common Metals 58 (1978) 101–105; doi:

data_1521931
_publ_section_title
;
 Structure cristalline de sulfates doubles de sodium et de terres rares
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              101
_journal_page_last               105
_journal_volume                  58
_journal_year                    1978
_chemical_formula_sum            'Er Na O8 S2'
_chemical_name_systematic        'Na Er (S O4)2'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2c'
_symmetry_space_group_name_H-M   'P 1 1 21/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                96.71
_cell_formula_units_Z            2
_cell_length_a                   4.673
_cell_length_b                   9.575
_cell_length_c                   6.861
_cell_volume                     304.886
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Sirotinkin_JCOMAH_1978_1656.cif
_cod_data_source_block           Er1Na1O8S2
_cod_original_cell_volume        304.8856
_cod_original_sg_symbol_Hall     '-P 2yb (z,x,y)'
_cod_original_formula_sum        'Er1 Na1 O8 S2'
_cod_database_code               1521931
The crystal structures of Ba2 R2/3 V2 O8 (R = La, Nd) and Sr2 La2/3 V2 O8; palmierite derivatives
Skakle, J.M.S.; Coats, A.M.; Marr, J.; Journal of Materials Science 35 (2000) 3251–3256; doi:

data_1521932
_publ_section_title
;
 The crystal structures of Ba2 R2/3 V2 O8 (R = La, Nd) and Sr2 La2/3 V2
 O8; palmierite derivatives
;
_journal_name_full               'Journal of Materials Science'
_journal_page_first              3251
_journal_page_last               3256
_journal_volume                  35
_journal_year                    2000
_chemical_formula_sum            'Ba2 La0.667 O8 V2'
_chemical_name_systematic        'Ba2 La0.667 V2 O8'
_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                   5.75271
_cell_length_b                   5.75271
_cell_length_c                   21.04729
_cell_volume                     603.215
_citation_journal_id_ASTM        JMTSAS
_cod_data_source_file            Skakle_JMTSAS_2000_1580.cif
_cod_data_source_block           Ba2La0.667O8V2
_cod_original_cell_volume        603.2145
_cod_database_code               1521932
The crystal structures of Ba2 R2/3 V2 O8 (R = La, Nd) and Sr2 La2/3 V2 O8; palmierite derivatives
Skakle, J.M.S.; Coats, A.M.; Marr, J.; Journal of Materials Science 35 (2000) 3251–3256; doi:

data_1521933
_publ_section_title
;
 The crystal structures of Ba2 R2/3 V2 O8 (R = La, Nd) and Sr2 La2/3 V2
 O8; palmierite derivatives
;
_journal_name_full               'Journal of Materials Science'
_journal_page_first              3251
_journal_page_last               3256
_journal_volume                  35
_journal_year                    2000
_chemical_formula_sum            'La0.667 O8 Sr2 V2'
_chemical_name_systematic        'Sr2 La0.667 V2 O8'
_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                   5.6295
_cell_length_b                   5.6295
_cell_length_c                   19.9534
_cell_volume                     547.630
_citation_journal_id_ASTM        JMTSAS
_cod_data_source_file            Skakle_JMTSAS_2000_1581.cif
_cod_data_source_block           La0.667O8Sr2V2
_cod_original_cell_volume        547.6299
_cod_database_code               1521933
The crystal structures of Ba2 R2/3 V2 O8 (R = La, Nd) and Sr2 La2/3 V2 O8; palmierite derivatives
Skakle, J.M.S.; Coats, A.M.; Marr, J.; Journal of Materials Science 35 (2000) 3251–3256; doi:

data_1521934
_publ_section_title
;
 The crystal structures of Ba2 R2/3 V2 O8 (R = La, Nd) and Sr2 La2/3 V2
 O8; palmierite derivatives
;
_journal_name_full               'Journal of Materials Science'
_journal_page_first              3251
_journal_page_last               3256
_journal_volume                  35
_journal_year                    2000
_chemical_formula_sum            'Ba2 Nd0.667 O8 V2'
_chemical_name_systematic        'Ba2 Nd0.667 V2 O8'
_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                   5.6336
_cell_length_b                   5.6336
_cell_length_c                   20.08749
_cell_volume                     552.113
_citation_journal_id_ASTM        JMTSAS
_cod_data_source_file            Skakle_JMTSAS_2000_1582.cif
_cod_data_source_block           Ba2Nd0.667O8V2
_cod_original_cell_volume        552.1135
_cod_database_code               1521934
Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od
Skakle, J.M.S.; West, A.R.; Physica C (Amsterdam) 321 (1999) 12–28; doi:

data_1521935
_publ_section_title
;
 Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od
;
_journal_name_full               'Physica C (Amsterdam)'
_journal_page_first              12
_journal_page_last               28
_journal_volume                  321
_journal_year                    1999
_chemical_formula_sum            'Ba1.5 Ca0.5 Cu3 La O7.02'
_chemical_name_systematic        '(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O7.02'
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.88481
_cell_length_b                   3.88481
_cell_length_c                   11.7336
_cell_volume                     177.081
_citation_journal_id_ASTM        PHYCE6
_cod_data_source_file            Skakle_PHYCE6_1999_635.cif
_cod_data_source_block           Ba1.5Ca0.5Cu3La1O7.02
_cod_original_cell_volume        177.0805
_cod_original_formula_sum        'Ba1.5 Ca0.5 Cu3 La1 O7.02'
_cod_database_code               1521935
Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od
Skakle, J.M.S.; West, A.R.; Physica C (Amsterdam) 321 (1999) 12–28; doi:

data_1521936
_publ_section_title
;
 Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od
;
_journal_name_full               'Physica C (Amsterdam)'
_journal_page_first              12
_journal_page_last               28
_journal_volume                  321
_journal_year                    1999
_chemical_formula_sum            'Ba1.5 Ca0.5 Cu3 La O6.64'
_chemical_name_systematic        '(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.64'
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.88537
_cell_length_b                   3.88537
_cell_length_c                   11.77323
_cell_volume                     177.730
_citation_journal_id_ASTM        PHYCE6
_cod_data_source_file            Skakle_PHYCE6_1999_637.cif
_cod_data_source_block           Ba1.5Ca0.5Cu3La1O6.64
_cod_original_cell_volume        177.7299
_cod_original_formula_sum        'Ba1.5 Ca0.5 Cu3 La1 O6.64'
_cod_database_code               1521936
Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od
Skakle, J.M.S.; West, A.R.; Physica C (Amsterdam) 321 (1999) 12–28; doi:

data_1521937
_publ_section_title
;
 Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od
;
_journal_name_full               'Physica C (Amsterdam)'
_journal_page_first              12
_journal_page_last               28
_journal_volume                  321
_journal_year                    1999
_chemical_formula_sum            'Ba1.5 Ca0.5 Cu3 La O6.5'
_chemical_name_systematic        '(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.5'
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.88743
_cell_length_b                   3.88743
_cell_length_c                   11.7895
_cell_volume                     178.164
_citation_journal_id_ASTM        PHYCE6
_cod_data_source_file            Skakle_PHYCE6_1999_638.cif
_cod_data_source_block           Ba1.5Ca0.5Cu3La1O6.5
_cod_original_cell_volume        178.1642
_cod_original_formula_sum        'Ba1.5 Ca0.5 Cu3 La1 O6.5'
_cod_database_code               1521937