LMucko/crystallography-open-database huggingface dataset:
Red micas from basal ignimbrites of Mt. Vulture (Italy): interlayer content appraisal by a multi-methodic approach Note: Sample LC7_R4
Scordari, F.; Schingaro, E.; Ventruti, G.; Lacalamita, M.; Ottolini, L.; Physics and Chemistry of Minerals 35 (2008) 163–174; doi:10.1007/s00269-007-0208-0

data_9015541
_publ_section_title
;
 Red micas from basal ignimbrites of Mt. Vulture (Italy): interlayer content
 appraisal by a multi-methodic approach
 Note: Sample LC7_R4
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              163
_journal_page_last               174
_journal_paper_doi               10.1007/s00269-007-0208-0
_journal_volume                  35
_journal_year                    2008
_chemical_compound_source        'Mt. Vulture, Italy'
_chemical_formula_sum            'Fe0.925 H0.39 K Mg2.075 O12 Si4'
_chemical_name_mineral           Phlogopite
_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                 99.970
_cell_angle_gamma                90
_cell_length_a                   5.3237
_cell_length_b                   9.2149
_cell_length_c                   10.1597
_cell_formula_units_Z            2
_cell_volume                     490.881
_database_code_amcsd             0018311
_exptl_crystal_density_diffrn    3.017
_cod_original_formula_sum        'K (Mg2.075 Fe.925) Si4 O12 H.39'
_cod_database_code               9015541
The Crystal Structures of Potassium and Ammonium Chlorostannates _cod_database_code 1010078
Dickinson, R.; Journal of the American Chemical Society 44 (1922) 276–288; doi:10.1021/ja01423a006

data_9015542
_publ_section_title
;
 The Crystal Structures of Potassium and Ammonium Chlorostannates
 _cod_database_code 1010078
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              276
_journal_page_last               288
_journal_paper_doi               10.1021/ja01423a006
_journal_volume                  44
_journal_year                    1922
_chemical_formula_sum            'Cl6 H8 N2 Sn'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.05
_cell_length_b                   10.05
_cell_length_c                   10.05
_cell_volume                     1015.075
_database_code_amcsd             0017012
_exptl_crystal_density_diffrn    2.352
_cod_duplicate_entry             1010078
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'N2 Sn Cl6'
_cod_database_code               9015542
_amcsd_formula_title             'Cl6 H8 N2 Sn'
The Crystal Structures of Some Alkali Hydrosulfides and Monosulfides. _cod_database_code 1010252
West, C.; Zeitschrift fur Kristallographie 88 (1934) 97–115; doi:

data_9015543
_publ_section_title
;
 The Crystal Structures of Some Alkali Hydrosulfides and Monosulfides.
 _cod_database_code 1010252
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              97
_journal_page_last               115
_journal_volume                  88
_journal_year                    1934
_chemical_formula_sum            'Rb S'
_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                69.33
_cell_angle_beta                 69.33
_cell_angle_gamma                69.33
_cell_length_a                   4.53
_cell_length_b                   4.53
_cell_length_c                   4.53
_cell_formula_units_Z            1
_cell_volume                     78.559
_database_code_amcsd             0017183
_exptl_crystal_density_diffrn    2.484
_cod_duplicate_entry             1010252
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_database_code               9015543
_amcsd_formula_title             'H Rb S'
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K determined by time-of-flight neutron powder diffraction Note: T = 180 K
Wood, I. G.; Vocadlo, L.; Knight, K. S.; Dobson, D. P.; Marshall, W. G.; Price, G. D.; Brodholt, J.; Journal of Applied Crystallography 37 (2004) 82–90; doi:10.1107/S0021889803024695

data_9015544
_publ_section_title
;
 Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
 determined by time-of-flight neutron powder diffraction
 Note: T = 180 K
;
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              82
_journal_page_last               90
_journal_paper_doi               10.1107/S0021889803024695
_journal_volume                  37
_journal_year                    2004
_chemical_compound_source        Synthetic
_chemical_formula_sum            'C Fe3'
_chemical_name_mineral           Cohenite
_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                   5.082
_cell_length_b                   6.743
_cell_length_c                   4.512
_cell_measurement_temperature    180
_cell_volume                     154.617
_database_code_amcsd             0019107
_diffrn_ambient_temperature      180
_exptl_crystal_density_diffrn    7.713
_cod_duplicate_entry             2300070
_cod_depositor_comments
;
 Adding the _cell_measurement_temperature and _diffrn_ambient_temperature
 data items after consulting the original publication.

 Antanas Vaitkus,
 2017-08-17

 Adding the _cell_formula_units_Z data item after consulting the original
 publication.

 Antanas Vaitkus,
 2017-08-17
;
_cod_original_formula_sum        'Fe3 C'
_cod_database_code               9015544
Kristallstrukturen und Wasserstoffbruckenbindungen bei beta-Be(OH)2 und epsilon-Zn(OH)2 Note: X-ray single-crystal
Stahl, R.; Jung, C.; Lutz, H. D.; Kockelmann, W.; Jacobs, H.; Zeitschrift fur Anorganische und Allgemeine Chemie 624 (1998) 1130–1136; doi:10.1002/(SICI)1521-3749(199807)624:7<1130::AID-ZAAC1130>3.0.CO;2-G

data_9015545
_publ_section_title
;
 Kristallstrukturen und Wasserstoffbruckenbindungen bei beta-Be(OH)2
 und epsilon-Zn(OH)2
 Note: X-ray single-crystal
;
_journal_name_full
'Zeitschrift fur Anorganische und Allgemeine Chemie'
_journal_page_first              1130
_journal_page_last               1136
_journal_paper_doi
10.1002/(SICI)1521-3749(199807)624:7<1130::AID-ZAAC1130>3.0.CO;2-G
_journal_volume                  624
_journal_year                    1998
_chemical_formula_sum            'H2 O2 Zn'
_chemical_name_mineral           Wulfingite
_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_length_a                   4.905
_cell_length_b                   5.143
_cell_length_c                   8.473
_cell_formula_units_Z            4
_cell_volume                     213.743
_database_code_amcsd             0018272
_exptl_crystal_density_diffrn    3.089
_cod_original_formula_sum        'Zn O2 H2'
_cod_database_code               9015545
Effects of extra oxygen on the structure and superconductivity of La2-xCaxCuO4+y prepared by chemical oxidation _cod_database_code 1006184
Rial, C.; Moran, E.; Alario-Franco M; Amador, U.; Martinez, J.; Rodriguez-Carvajal J; Andersen, N.; Physica C 297 (1998) 277–293; doi:

data_9015546
_publ_section_title
;
 Effects of extra oxygen on the structure and superconductivity of
 La2-xCaxCuO4+y prepared by chemical oxidation
 _cod_database_code 1006184
;
_journal_name_full               'Physica C'
_journal_page_first              277
_journal_page_last               293
_journal_volume                  297
_journal_year                    1998
_chemical_formula_sum            'Ca0.05 Cu La1.95 O4.07'
_space_group_IT_number           64
_symmetry_space_group_name_Hall  '-B 2ab 2'
_symmetry_space_group_name_H-M   'B m a b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.3514
_cell_length_b                   5.3730
_cell_length_c                   13.1945
_cell_formula_units_Z            4
_cell_volume                     379.382
_database_code_amcsd             0015093
_exptl_crystal_density_diffrn    7.030
_cod_duplicate_entry             1006184
_cod_original_formula_sum        '(La1.95 Ca.05) Cu O4.07'
_cod_database_code               9015546
_amcsd_formula_title             'Ca0.05 Cu La1.95 O4.09'
Ein Umwandlungspunkt der Ammoniumsalze zwischen -30 und -40 Grad _cod_database_code 1010404
Simon, F.; Simson, C.; Naturwissenschaften 14 (1926) 880–881; doi:10.1007/BF01490355

data_9015547
_publ_section_title
;
 Ein Umwandlungspunkt der Ammoniumsalze zwischen -30 und -40 Grad
 _cod_database_code 1010404
;
_journal_name_full               Naturwissenschaften
_journal_page_first              880
_journal_page_last               881
_journal_paper_doi               10.1007/BF01490355
_journal_volume                  14
_journal_year                    1926
_chemical_formula_sum            'H4 I N'
_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                   4.37
_cell_length_b                   4.37
_cell_length_c                   4.37
_cell_volume                     83.453
_database_code_amcsd             0017329
_exptl_crystal_density_diffrn    2.804
_cod_duplicate_entry             1010404
_cod_original_sg_symbol_H-M      'P m 3 m'
_cod_original_formula_sum        'N I'
_cod_database_code               9015547
_amcsd_formula_title             'H4 I N'
Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen ABO3 _cod_database_code 1010589
Zachariasen, W.; Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1 (1928) 1–165; doi:

data_9015548
_publ_section_title
;
 Untersuchungen ueber die Kristallstruktur von Sesquioxyden und
 Verbindungen ABO3
 _cod_database_code 1010589
;
_journal_name_full
'Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo'
_journal_page_first              1
_journal_page_last               165
_journal_volume                  1
_journal_year                    1928
_chemical_formula_sum            'O3 Sm2'
_space_group_IT_number           199
_symmetry_space_group_name_Hall  'I 2b 2c 3'
_symmetry_space_group_name_H-M   'I 21 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   10.85
_cell_length_b                   10.85
_cell_length_c                   10.85
_cell_formula_units_Z            16
_cell_volume                     1277.289
_database_code_amcsd             0017470
_exptl_crystal_density_diffrn    7.254
_cod_duplicate_entry             1010589
_cod_original_formula_sum        'Sm2 O3'
_cod_database_code               9015548
_amcsd_formula_title             'O3 Sm2'
Anorpiment, As2S3, the triclinic dimorph of orpiment
Kampf, A. R.; Downs, R. T.; Housley, R. M.; Jenkins, R. A.; Hyrsl, J.; Mineralogical Magazine 75 (2011) 2857–2867; doi:10.1180/minmag.2011.075.6.2857

data_9015549
_publ_section_title
;
 Anorpiment, As2S3, the triclinic dimorph of orpiment
;
_journal_name_full               'Mineralogical Magazine'
_journal_page_first              2857
_journal_page_last               2867
_journal_paper_doi               10.1180/minmag.2011.075.6.2857
_journal_volume                  75
_journal_year                    2011
_chemical_compound_source
'Palomo mine, Castrovirreyna Province, Huancavelica Department, Peru'
_chemical_formula_sum            'As2 S3'
_chemical_name_mineral           Anorpiment
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                78.152
_cell_angle_beta                 75.817
_cell_angle_gamma                89.861
_cell_formula_units_Z            4
_cell_length_a                   5.7577
_cell_length_b                   8.7169
_cell_length_c                   10.2682
_cell_volume                     488.377
_database_code_amcsd             0018526
_exptl_crystal_density_diffrn    3.346
_cod_database_code               9015549
Solving Structural Problems of Ceramic Materials
Golobic, A.; Skapin, S. D.; Suvorov, D.; Meden, A.; Croatica Chemica Acta 77 (2004) 435–446; doi:

data_9015550
_publ_section_title
;
 Solving Structural Problems of Ceramic Materials
;
_journal_issue                   3
_journal_name_full               'Croatica Chemica Acta'
_journal_page_first              435
_journal_page_last               446
_journal_volume                  77
_journal_year                    2004
_chemical_compound_source        Synthetic
_chemical_formula_sum            'La0.741 Nb1.778 O6 Ti0.222'
_chemical_name_common            'Compound 3'
_space_group_IT_number           65
_symmetry_space_group_name_Hall  '-C 2 2'
_symmetry_space_group_name_H-M   'C m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.80411
_cell_length_b                   7.82272
_cell_length_c                   7.92310
_cell_formula_units_Z            4
_cell_volume                     483.700
_database_code_amcsd             0018961
_exptl_crystal_density_diffrn    5.146
_cod_original_formula_sum        'La.741 (Nb1.778 Ti.222) O6'
_cod_database_code               9015550
_amcsd_formula_title             La0.37Nb0.889Ti0.111O3
Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl15a2
Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U.; American Mineralogist 97 (2012) 1821–1827; doi:10.2138/am.2012.4177

data_9015551
_publ_section_title
;
 Cation ordering over short-range and long-range scales
 in the MgAl2O4-CuAl2O4 series
 Sample: CuAl15a2
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1821
_journal_page_last               1827
_journal_paper_doi               10.2138/am.2012.4177
_journal_volume                  97
_journal_year                    2012
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Al2 Cu0.06 Mg0.94 O4'
_chemical_name_mineral           Spinel
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.0858
_cell_length_b                   8.0858
_cell_length_c                   8.0858
_cell_formula_units_Z            8
_cell_volume                     528.651
_database_code_amcsd             0019564
_exptl_crystal_density_diffrn    3.634
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_original_formula_sum        '(Cu.06 Mg.94 Al2) O4'
_cod_database_code               9015551
Synthesis, structural analyses, and unusual magnetic properties of Ba2CoSi2O7 and BaCo2Si2O7 Note: Compound 2
Adams, R. D.; Layland, R.; Payen, C.; Datta, T.; Inorganic Chemistry 35 (1996) 3492–3497; doi:10.1021/ic960167m

data_9015552
_publ_section_title
;
 Synthesis, structural analyses, and unusual magnetic properties of
 Ba2CoSi2O7 and BaCo2Si2O7
 Note: Compound 2
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3492
_journal_page_last               3497
_journal_paper_doi               10.1021/ic960167m
_journal_volume                  35
_journal_year                    1996
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Ba Co2 O7 Si2'
_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                 90.299
_cell_angle_gamma                90
_cell_length_a                   7.2131
_cell_length_b                   12.781
_cell_length_c                   13.762
_cell_formula_units_Z            8
_cell_volume                     1268.710
_database_code_amcsd             0019237
_exptl_crystal_density_diffrn    4.433
_cod_original_formula_sum        'Ba Co2 Si2 O7'
_cod_database_code               9015552
_amcsd_formula_title             BaCo2Si2O7
Crystal chemistry of cancrinite-group minerals with an AB-type framework: A review and new data. I. Chemical and structural variations Note: Sample# Kovd15/1
Pekov, I. V.; Olysych, L. V.; Chukanov, N. V.; Zubkova, N. V.; Pushcharovsky D Yu; Van, K. V.; Giester, G.; Tillmanns, E.; The Canadian Mineralogist 49 (2012) 1129–1150; doi:10.3749/canmin.49.5.1129

data_9015553
_publ_section_title
;
 Crystal chemistry of cancrinite-group minerals with an AB-type framework:
 A review and new data. I. Chemical and structural variations
 Note: Sample# Kovd15/1
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              1129
_journal_page_last               1150
_journal_paper_doi               10.3749/canmin.49.5.1129
_journal_volume                  49
_journal_year                    2012
_chemical_compound_source        Kovdor
_chemical_formula_sum
'C0.437 H1.998 Al2.67 K0.15 Na3.43 O14.31 Si3.33'
_chemical_name_mineral           Cancrinite
_space_group_IT_number           173
_symmetry_space_group_name_Hall  'P 6c'
_symmetry_space_group_name_H-M   'P 63'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   12.683
_cell_length_b                   12.683
_cell_length_c                   5.190
_cell_volume                     723.006
_database_code_amcsd             0018868
_exptl_crystal_density_diffrn    2.235
_cod_original_formula_sum        'Si3.33 Al2.67 O14.31 Na3.43 K.15 C.437 H1.998'
_cod_database_code               9015553
Cordylite-(La), a new mineral species in fenite from the Biraya Fe-REE deposit, Irkutsk, Russia Note: crystal 1
Mills, S. J.; Kartashov, P. M.; Kampf, A. R.; Konev, A. A.; Koneva, A. A.; Raudsepp, M.; The Canadian Mineralogist 50 (2012) 1281–1290; doi:10.3749/canmin.50.5.1281

data_9015554
_publ_section_title
;
 Cordylite-(La), a new mineral species in fenite from the Biraya Fe-REE
 deposit, Irkutsk, Russia
 Note: crystal 1
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              1281
_journal_page_last               1290
_journal_paper_doi               10.3749/canmin.50.5.1281
_journal_volume                  50
_journal_year                    2012
_chemical_compound_source        'Biraya Fe-REE deposit, Irkutsk, Russia'
_chemical_formula_sum
'C4 H0.03 Ba Ca0.39 Ce0.66 F0.89 La0.78 Na0.61 Nd0.08 O12.03 Pr0.02 Sr0.44'
_chemical_name_mineral           Cordylite-(La)
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   5.1182
_cell_length_b                   5.1182
_cell_length_c                   23.1785
_cell_volume                     525.836
_database_code_amcsd             0019703
_exptl_crystal_density_diffrn    4.283
_cod_original_formula_sum
'Ba La.78 Ce.66 Sr.44 Nd.08 Pr.02 (Na.61 Ca.39) F.89 O12.03 C4 H.03'
_cod_database_code               9015554
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition Note: run P19, P = 46.4 GPa
Lavina, B.; Dera, P.; Downs, R. T.; Yang, W.; Sinogeikin, S.; Meng, Y.; Shen, G.; Schiferl, D.; Physical Review B 82 (2010) 064110–064118; doi:10.1103/PhysRevB.82.064110

data_9015555
_publ_section_title
;
 Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
 Note: run P19, P = 46.4 GPa
;
_journal_name_full               'Physical Review B'
_journal_page_first              064110
_journal_page_last               064118
_journal_paper_doi               10.1103/PhysRevB.82.064110
_journal_volume                  82
_journal_year                    2010
_chemical_compound_source        'Invigtut, Greenland'
_chemical_formula_sum            'C Fe O3'
_chemical_name_mineral           Siderite
_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_length_a                   4.367
_cell_length_b                   4.367
_cell_length_c                   12.78
_cell_formula_units_Z            6
_cell_volume                     211.071
_database_code_amcsd             0017580
_exptl_crystal_density_diffrn    5.469
_cod_original_sg_symbol_H-M      'R -3 c'
_cod_original_formula_sum        'Fe C O3'
_cod_database_code               9015555
The crystal structure of clinochalcomenite Note: reported coordinates do not produce the reported bond lengths
Lo, K.; Chen, Z.; Ma, Z.; Kexue Tongbao 29 (1984) 352–355; doi:

data_9015556
_publ_section_title
;
 The crystal structure of clinochalcomenite
 Note: reported coordinates do not produce the reported bond lengths
;
_journal_name_full               'Kexue Tongbao'
_journal_page_first              352
_journal_page_last               355
_journal_volume                  29
_journal_year                    1984
_chemical_compound_source        'Gansu Province, China'
_chemical_formula_sum            'Cu H4 O5 Se'
_chemical_name_mineral           Clinochalcomenite
_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                 97.27
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.177
_cell_length_b                   8.611
_cell_length_c                   6.290
_cell_volume                     439.332
_database_code_amcsd             0018480
_exptl_crystal_density_diffrn    3.425
_cod_original_formula_sum        'Cu Se O5 H4'
_cod_database_code               9015556
Studies of the formation and reduction of a mixed three-dimensional perovskite of copper and titanium _cod_database_code 1006117
Palacin, M.; Bassas, J.; Rodriguez-Carvajal J; Fuertes, A.; Casan-Pastor N; Gomez-Romero P; Materials Research Bulletin 29 (1994) 973–980; doi:10.1016/0025-5408(94)90058-2

data_9015557
_publ_section_title
;
 Studies of the formation and reduction of a mixed three-dimensional
 perovskite of copper and titanium
 _cod_database_code 1006117
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              973
_journal_page_last               980
_journal_paper_doi               10.1016/0025-5408(94)90058-2
_journal_volume                  29
_journal_year                    1994
_chemical_formula_sum            'Cu0.48 La O3 Ti0.52'
_chemical_name_mineral           'Perovskite (La, Cu, Ti)'
_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_length_a                   5.575
_cell_length_b                   7.866
_cell_length_c                   5.579
_cell_formula_units_Z            4
_cell_volume                     244.656
_database_code_amcsd             0014369
_exptl_crystal_density_diffrn    6.578
_cod_duplicate_entry             1006117
_cod_original_formula_sum        'La (Cu.48 Ti.52) O3'
_cod_database_code               9015557