LMucko/crystallography-open-database huggingface dataset:
The crystal structure of pararobertsite and its relationship to mitridatite
Kampf, A. R.; American Mineralogist 85 (2000) 1302–1306; doi:

data_9002428
_publ_section_title
;
 The crystal structure of pararobertsite and its relationship to mitridatite
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1302
_journal_page_last               1306
_journal_volume                  85
_journal_year                    2000
_chemical_compound_source
'Tip Top pegmatite, Custer County, South Dakota, USA'
_chemical_formula_sum            'Ca2 H6 Mn3 O17 P3'
_chemical_name_mineral           Pararobertsite
_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                 101.184
_cell_angle_gamma                90
_cell_length_a                   8.814
_cell_length_b                   13.233
_cell_length_c                   11.056
_cell_formula_units_Z            4
_cell_volume                     1265.035
_database_code_amcsd             0002513
_exptl_crystal_density_diffrn    3.234
_cod_original_formula_sum        'Mn3 Ca2 P3 O17 H6'
_cod_database_code               9002428
Description and crystal structure of cabalzarite Ca(Mg,Al,Fe)2(AsO4)2(H2O,OH)2, a new mineral of the tsumcorite group
Brugger, J.; Meisser, N.; Schenk, K.; Berlepsch, P.; Bonin, M.; Armbruster, T.; Nyfeler, D.; Schmidt, S.; American Mineralogist 85 (2000) 1307–1314; doi:

data_9002429
_publ_section_title
;Description and crystal structure of cabalzarite
 Ca(Mg,Al,Fe)2(AsO4)2(H2O,OH)2, a new mineral of the tsumcorite group
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1307
_journal_page_last               1314
_journal_volume                  85
_journal_year                    2000
_chemical_compound_source        'Falotta, Graubunden, Switzerland'
_chemical_formula_sum            'Al0.816 As2 Ca Fe0.354 H3 Mg0.784 Mn0.046 O10'
_chemical_name_mineral           Cabalzarite
_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                 115.25
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.925
_cell_length_b                   6.143
_cell_length_c                   7.352
_cell_volume                     364.570
_database_code_amcsd             0002514
_exptl_crystal_density_diffrn    3.792
_cod_original_formula_sum        'Ca (Mg.784 Al.816 Fe.354 Mn.046) As2 O10 H3'
_cod_database_code               9002429
Description and crystal structure of cabalzarite Ca(Mg,Al,Fe)2(AsO4)2(H2O,OH)2, a new mineral of the tsumcorite group
Brugger, J.; Meisser, N.; Schenk, K.; Berlepsch, P.; Bonin, M.; Armbruster, T.; Nyfeler, D.; Schmidt, S.; American Mineralogist 85 (2000) 1307–1314; doi:

data_9002430
_publ_section_title
;Description and crystal structure of cabalzarite
 Ca(Mg,Al,Fe)2(AsO4)2(H2O,OH)2, a new mineral of the tsumcorite group
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1307
_journal_page_last               1314
_journal_volume                  85
_journal_year                    2000
_chemical_compound_source        'Falotta, Graubunden, Switzerland'
_chemical_formula_sum            'Al0.84 As2 Ca Fe0.08 H3 Mg0.82 Mn0.26 O10'
_chemical_name_mineral           Cabalzarite
_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                 115.494
_cell_angle_gamma                90
_cell_length_a                   8.9284
_cell_length_b                   6.1314
_cell_length_c                   7.3439
_cell_formula_units_Z            2
_cell_volume                     362.886
_database_code_amcsd             0002515
_exptl_crystal_density_diffrn    3.791
_cod_original_formula_sum        'Ca (Mg.82 Al.84 Fe.08 Mn.26) As2 O10 H3'
_cod_database_code               9002430
Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: La-ClAp
Fleet M E; Liu X; Pan Y; American Mineralogist 85 (2000) 1437–1446; doi:

data_9002431
_publ_section_title
;
 Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]:
 Uptake, site preference, and degradation of monoclinic structure
 Sample: La-ClAp
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1437
_journal_page_last               1446
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca4.899 Cl2 La0.052 Na0.05 O12 P3'
_chemical_name_mineral           Chlorapatite
_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_length_a                   9.6499
_cell_length_b                   9.6499
_cell_length_c                   6.7725
_cell_formula_units_Z            2
_cell_volume                     546.167
_cod_original_formula_sum        'Ca4.899 Na.05 La.052 P3 O12 Cl2'
_cod_database_code               9002431
_database_code_amcsd 0002516
Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: Nd-ClAp
Fleet M E; Liu X; Pan Y; American Mineralogist 85 (2000) 1437–1446; doi:

data_9002432
_publ_section_title
;
 Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]:
 Uptake, site preference, and degradation of monoclinic structure
 Sample: Nd-ClAp
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1437
_journal_page_last               1446
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca4.822 Cl2 Na0.087 Nd0.092 O12 P3'
_chemical_name_mineral           Chlorapatite
_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_length_a                   9.6474
_cell_length_b                   9.6474
_cell_length_c                   6.7747
_cell_formula_units_Z            2
_cell_volume                     546.061
_cod_original_formula_sum        'Ca4.822 Nd.092 Na.087 P3 O12 Cl2'
_cod_database_code               9002432
_database_code_amcsd 0002517
Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: Dy-ClAp
Fleet M E; Liu X; Pan Y; American Mineralogist 85 (2000) 1437–1446; doi:

data_9002433
_publ_section_title
;
 Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]:
 Uptake, site preference, and degradation of monoclinic structure
 Sample: Dy-ClAp
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1437
_journal_page_last               1446
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca4.857 Cl2 Dy0.069 Na0.072 O12 P3'
_chemical_name_mineral           Chlorapatite
_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_length_a                   9.6487
_cell_length_b                   9.6487
_cell_length_c                   6.7652
_cell_formula_units_Z            2
_cell_volume                     545.442
_cod_original_formula_sum        'Ca4.857 Na.072 Dy.069 P3 O12 Cl2'
_cod_database_code               9002433
_database_code_amcsd 0002518
Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: La-ClAp
Fleet M E; Liu X; Pan Y; American Mineralogist 85 (2000) 1437–1446; doi:

data_9002434
_publ_section_title
;
 Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]:
 Uptake, site preference, and degradation of monoclinic structure
 Sample: La-ClAp
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1437
_journal_page_last               1446
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca4.899 Cl La0.052 Na0.05 O12 P3'
_chemical_name_mineral           Chlorapatite
_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                120.
_cell_length_a                   9.6501
_cell_length_b                   19.3002
_cell_length_c                   6.7724
_cell_formula_units_Z            4
_cell_volume                     1092.363
_cod_original_formula_sum        'Ca4.899 Na.05 La.052 P3 O12 Cl'
_cod_database_code               9002434
_database_code_amcsd 0002519
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #001 at P = 0.21 GPa, T = 300 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002435
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #001 at P = 0.21 GPa, T = 300 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.786
_cell_angle_gamma                90
_cell_length_a                   7.0572
_cell_length_b                   8.7108
_cell_length_c                   6.5534
_cell_formula_units_Z            4
_cell_volume                     368.643
_database_code_amcsd             0002524
_diffrn_ambient_pressure         2.1e+05
_diffrn_ambient_temperature      300
_exptl_crystal_density_diffrn    3.532
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002435
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #002 at P = 0.87 GPa, T = 609 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002436
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #002 at P = 0.87 GPa, T = 609 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.735
_cell_angle_gamma                90
_cell_length_a                   7.0512
_cell_length_b                   8.7141
_cell_length_c                   6.5521
_cell_formula_units_Z            4
_cell_volume                     368.540
_database_code_amcsd             0002525
_diffrn_ambient_pressure         8.7e+05
_diffrn_ambient_temperature      609
_exptl_crystal_density_diffrn    3.533
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002436
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #003 at P = 0.71 GPa, T = 483 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002437
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #003 at P = 0.71 GPa, T = 483 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.742
_cell_angle_gamma                90
_cell_length_a                   7.0494
_cell_length_b                   8.7102
_cell_length_c                   6.5484
_cell_formula_units_Z            4
_cell_volume                     368.054
_database_code_amcsd             0002526
_diffrn_ambient_pressure         7.1e+05
_diffrn_ambient_temperature      483
_exptl_crystal_density_diffrn    3.538
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002437
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #004 at P = 1.21 GPa, T = 670 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002438
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #004 at P = 1.21 GPa, T = 670 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.705
_cell_angle_gamma                90
_cell_length_a                   7.0442
_cell_length_b                   8.7132
_cell_length_c                   6.5476
_cell_formula_units_Z            4
_cell_volume                     367.968
_database_code_amcsd             0002527
_diffrn_ambient_pressure         1.21e+06
_diffrn_ambient_temperature      670
_exptl_crystal_density_diffrn    3.539
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002438
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #005 at P = 1.26 GPa, T = 648 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002439
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #005 at P = 1.26 GPa, T = 648 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.686
_cell_angle_gamma                90
_cell_length_a                   7.0391
_cell_length_b                   8.7100
_cell_length_c                   6.5433
_cell_formula_units_Z            4
_cell_volume                     367.379
_database_code_amcsd             0002528
_diffrn_ambient_pressure         1.26e+06
_diffrn_ambient_temperature      648
_exptl_crystal_density_diffrn    3.544
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002439
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #006 at P = 1.23 GPa, T = 628 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002440
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #006 at P = 1.23 GPa, T = 628 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.682
_cell_angle_gamma                90
_cell_length_a                   7.0411
_cell_length_b                   8.7106
_cell_length_c                   6.5441
_cell_formula_units_Z            4
_cell_volume                     367.565
_database_code_amcsd             0002529
_diffrn_ambient_pressure         1.23e+06
_diffrn_ambient_temperature      628
_exptl_crystal_density_diffrn    3.543
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002440
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #007 at P = 1.70 GPa, T = 627 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002441
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #007 at P = 1.70 GPa, T = 627 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-A 2ya'
_symmetry_space_group_name_H-M   'A 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.619
_cell_angle_gamma                90
_cell_length_a                   7.0246
_cell_length_b                   8.7037
_cell_length_c                   6.5329
_cell_formula_units_Z            4
_cell_volume                     365.962
_database_code_amcsd             0002530
_diffrn_ambient_pressure         1.7e+06
_diffrn_ambient_temperature      627
_exptl_crystal_density_diffrn    3.558
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002441
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #008 at P = 1.69 GPa, T = 518 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002442
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #008 at P = 1.69 GPa, T = 518 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.594
_cell_angle_gamma                90
_cell_length_a                   7.0187
_cell_length_b                   8.6965
_cell_length_c                   6.5243
_cell_formula_units_Z            4
_cell_volume                     364.941
_database_code_amcsd             0002531
_diffrn_ambient_pressure         1.69e+06
_diffrn_ambient_temperature      518
_exptl_crystal_density_diffrn    3.568
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002442
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #009 at P = 1.77 GPa, T = 555 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002443
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #009 at P = 1.77 GPa, T = 555 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.617
_cell_angle_gamma                90
_cell_length_a                   7.0186
_cell_length_b                   8.6983
_cell_length_c                   6.5272
_cell_formula_units_Z            4
_cell_volume                     365.109
_database_code_amcsd             0002532
_diffrn_ambient_pressure         1.77e+06
_diffrn_ambient_temperature      555
_exptl_crystal_density_diffrn    3.566
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002443
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #010 at P = 1.84 GPa, T = 581 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002444
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #010 at P = 1.84 GPa, T = 581 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-A 2ya'
_symmetry_space_group_name_H-M   'A 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.603
_cell_angle_gamma                90
_cell_length_a                   7.0169
_cell_length_b                   8.6981
_cell_length_c                   6.5264
_cell_formula_units_Z            4
_cell_volume                     365.007
_database_code_amcsd             0002533
_diffrn_ambient_pressure         1.84e+06
_diffrn_ambient_temperature      581
_exptl_crystal_density_diffrn    3.567
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002444
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #011 at P = 1.88 GPa, T = 560 K
Kunz, M.; Arlt, T.; Stolz, J.; American Mineralogist 85 (2000) 1465–1473; doi:

data_9002445
_publ_section_title
;
 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
 and high temperature
 Sample #011 at P = 1.88 GPa, T = 560 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1465
_journal_page_last               1473
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca O5 Si Ti'
_chemical_name_mineral           Titanite
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-A 2ya'
_symmetry_space_group_name_H-M   'A 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.592
_cell_angle_gamma                90
_cell_length_a                   7.0158
_cell_length_b                   8.6986
_cell_length_c                   6.5257
_cell_formula_units_Z            4
_cell_volume                     364.962
_database_code_amcsd             0002534
_diffrn_ambient_pressure         1.88e+06
_diffrn_ambient_temperature      560
_exptl_crystal_density_diffrn    3.568
_cod_original_formula_sum        'Ca Ti Si O5'
_cod_database_code               9002445