LMucko/crystallography-open-database huggingface dataset:
Crystal chemistry of synthetic Mn-bearing anorthite: Incorporation of MnAl2Si2O8 end-member into feldspar Note: U(1,1) for Obo altered to reproduce Uiso
Matsui, T.; Kimata, M.; European Journal of Mineralogy 9 (1997) 333–344; doi:

data_9005309
_publ_section_title
;
 Crystal chemistry of synthetic Mn-bearing anorthite:
 Incorporation of MnAl2Si2O8 end-member into feldspar
 Note: U(1,1) for Obo altered to reproduce Uiso
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              333
_journal_page_last               344
_journal_volume                  9
_journal_year                    1997
_chemical_formula_sum            'Al1.911 Ca0.716 Mn0.196 Na0.045 O8 Si2.089'
_chemical_name_mineral           Anorthite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)'
_symmetry_space_group_name_H-M   'C -1'
_cell_angle_alpha                94.03
_cell_angle_beta                 115.90
_cell_angle_gamma                90.72
_cell_formula_units_Z            4
_cell_length_a                   8.131
_cell_length_b                   12.847
_cell_length_c                   7.069
_cell_volume                     661.839
_database_code_amcsd             0006694
_exptl_crystal_density_diffrn    2.797
_cod_original_formula_sum        'Mn.196 Ca.716 Na.045 (Al1.911 Si2.089) O8'
_cod_database_code               9005309
Subsilicic ferrian aluminian diopside from the Chelyabinsk coal basin (Southern Urals) - an unusual clinopyroxene
Kabalov, Y. K.; Oeckler, O.; Sokolova, E. V.; Mironov, A. B.; Chesnokov, B. V.; European Journal of Mineralogy 9 (1997) 617–621; doi:

data_9005310
_publ_section_title
;
 Subsilicic ferrian aluminian diopside from the Chelyabinsk
 coal basin (Southern Urals) - an unusual clinopyroxene
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              617
_journal_page_last               621
_journal_volume                  9
_journal_year                    1997
_chemical_compound_source        'Chelyabinsk coal basin, Southern Urals'
_chemical_formula_sum            'Al0.6 Ca0.96 Fe0.51 Mg0.44 O6 Si1.4'
_chemical_name_mineral           Diopside
_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                 105.87
_cell_angle_gamma                90
_cell_length_a                   9.786
_cell_length_b                   8.860
_cell_length_c                   5.338
_cell_formula_units_Z            4
_cell_volume                     445.185
_database_code_amcsd             0006695
_exptl_crystal_density_diffrn    3.419
_cod_original_formula_sum        'Fe.51 Al.6 Mg.44 Ca.96 Si1.4 O6'
_cod_database_code               9005310
Proton disorder in dehydrated hemimorphite - IR spectroscopy and X-ray structure refinement at low and ambient temperatures T = 110 K
Libowitzky, E.; Kohler, T.; Armbruster, T.; Rossman, G. R.; European Journal of Mineralogy 9 (1997) 803–810; doi:

data_9005311
_publ_section_title
;
 Proton disorder in dehydrated hemimorphite - IR spectroscopy
 and X-ray structure refinement at low and ambient temperatures
 T = 110 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              803
_journal_page_last               810
_journal_volume                  9
_journal_year                    1997
_chemical_formula_sum            'H2 O9 Si2 Zn4'
_chemical_name_mineral           Hemimorphite
_space_group_IT_number           44
_symmetry_space_group_name_Hall  'I 2 -2'
_symmetry_space_group_name_H-M   'I m m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.181
_cell_length_b                   10.841
_cell_length_c                   5.081
_cell_formula_units_Z            2
_cell_volume                     450.635
_database_code_amcsd             0006696
_diffrn_ambient_temperature      110
_exptl_crystal_density_diffrn    3.418
_cod_original_formula_sum        'Zn4 Si2 O9 H2'
_cod_database_code               9005311
Proton disorder in dehydrated hemimorphite - IR spectroscopy and X-ray structure refinement at low and ambient temperatures T = 293 K
Libowitzky, E.; Kohler, T.; Armbruster, T.; Rossman, G. R.; European Journal of Mineralogy 9 (1997) 803–810; doi:

data_9005312
_publ_section_title
;
 Proton disorder in dehydrated hemimorphite - IR spectroscopy
 and X-ray structure refinement at low and ambient temperatures
 T = 293 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              803
_journal_page_last               810
_journal_volume                  9
_journal_year                    1997
_chemical_formula_sum            'H2 O9 Si2 Zn4'
_chemical_name_mineral           Hemimorphite
_space_group_IT_number           44
_symmetry_space_group_name_Hall  'I 2 -2'
_symmetry_space_group_name_H-M   'I m m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.191
_cell_length_b                   10.824
_cell_length_c                   5.088
_cell_formula_units_Z            2
_cell_volume                     451.099
_database_code_amcsd             0006697
_diffrn_ambient_temperature      293
_exptl_crystal_density_diffrn    3.414
_cod_original_formula_sum        'Zn4 Si2 O9 H2'
_cod_database_code               9005312
The temperature-dependent P2_1/c - C2/c phase transition in the clinopyroxene kanoite MnMg[Si2O6]: a single-crystal X-ray and optical study T = 200 C
Arlt, T.; Armbruster, T.; European Journal of Mineralogy 9 (1997) 953–964; doi:

data_9005313
_publ_section_title
;
 The temperature-dependent P2_1/c - C2/c phase transition in the
 clinopyroxene kanoite MnMg[Si2O6]: a single-crystal X-ray and optical study
 T = 200 C
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              953
_journal_page_last               964
_journal_volume                  9
_journal_year                    1997
_chemical_formula_sum            'Ca0.07 Mg1.109 Mn0.821 O6 Si2'
_chemical_name_mineral           Kanoite
_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                 108.74
_cell_angle_gamma                90
_cell_length_a                   9.758
_cell_length_b                   8.897
_cell_length_c                   5.283
_cell_formula_units_Z            4
_cell_volume                     434.339
_database_code_amcsd             0006698
_diffrn_ambient_temperature      473.15
_exptl_crystal_density_diffrn    3.472
_cod_original_formula_sum        'Mg1.109 Mn.821 Ca.07 Si2 O6'
_cod_database_code               9005313
The temperature-dependent P2_1/c - C2/c phase transition in the clinopyroxene kanoite MnMg[Si2O6]: a single-crystal X-ray and optical study T = 270 C
Arlt, T.; Armbruster, T.; European Journal of Mineralogy 9 (1997) 953–964; doi:

data_9005314
_publ_section_title
;
 The temperature-dependent P2_1/c - C2/c phase transition in the
 clinopyroxene kanoite MnMg[Si2O6]: a single-crystal X-ray and optical study
 T = 270 C
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              953
_journal_page_last               964
_journal_volume                  9
_journal_year                    1997
_chemical_formula_sum            'Ca0.07 Mg1.123 Mn0.807 O6 Si2'
_chemical_name_mineral           Kanoite
_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                 109.26
_cell_angle_gamma                90
_cell_length_a                   9.796
_cell_length_b                   8.880
_cell_length_c                   5.315
_cell_formula_units_Z            4
_cell_volume                     436.467
_database_code_amcsd             0006699
_diffrn_ambient_temperature      543.15
_exptl_crystal_density_diffrn    3.448
_cod_original_formula_sum        'Mg1.123 Mn.807 Ca.07 Si2 O6'
_cod_database_code               9005314
Crystal chemistry of meteoritic kirschsteinite Sample: KIR1
Folco, L.; Mellini, M.; European Journal of Mineralogy 9 (1997) 969–973; doi:

data_9005315
_publ_section_title
;
 Crystal chemistry of meteoritic kirschsteinite
 Sample: KIR1
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              969
_journal_page_last               973
_journal_volume                  9
_journal_year                    1997
_chemical_formula_sum            'Ca Fe0.77 Mg0.22 O4 Si'
_chemical_name_mineral           Kirschsteinite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.877
_cell_length_b                   11.166
_cell_length_c                   6.448
_cell_formula_units_Z            4
_cell_volume                     351.136
_database_code_amcsd             0006700
_exptl_crystal_density_diffrn    3.415
_cod_original_formula_sum        'Ca Fe.77 Mg.22 Si O4'
_cod_database_code               9005315
Crystal chemistry of meteoritic kirschsteinite Sample: KIR2 Note: U(1,1) of O1 altered to reproduce Uiso
Folco, L.; Mellini, M.; European Journal of Mineralogy 9 (1997) 969–973; doi:

data_9005316
_publ_section_title
;
 Crystal chemistry of meteoritic kirschsteinite
 Sample: KIR2
 Note: U(1,1) of O1 altered to reproduce Uiso
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              969
_journal_page_last               973
_journal_volume                  9
_journal_year                    1997
_chemical_formula_sum            'Ca Fe0.69 Mg0.31 O4 Si'
_chemical_name_mineral           Kirschsteinite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.875
_cell_length_b                   11.164
_cell_length_c                   6.447
_cell_formula_units_Z            4
_cell_volume                     350.875
_database_code_amcsd             0006701
_exptl_crystal_density_diffrn    3.374
_cod_original_formula_sum        'Ca (Fe.69 Mg.31) Si O4'
_cod_database_code               9005316
Ge-analogues of aluminium silicates: High-pressure synthesis and properties of orthorhombic Al2GeO4(OH)2 Note: Space group setting altered to match standard
Wunder, B.; Marler, B.; European Journal of Mineralogy 9 (1997) 1147–1158; doi:

data_9005317
_publ_section_title
;
 Ge-analogues of aluminium silicates: High-pressure synthesis
 and properties of orthorhombic Al2GeO4(OH)2
 Note: Space group setting altered to match standard
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              1147
_journal_page_last               1158
_journal_volume                  9
_journal_year                    1997
_chemical_formula_sum            'Al2 Ge H2 O6'
_chemical_name_mineral           Krieselite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.804
_cell_length_b                   9.107
_cell_length_c                   8.551
_cell_volume                     374.106
_database_code_amcsd             0006702
_exptl_crystal_density_diffrn    3.987
_cod_original_formula_sum        'Al2 Ge O6 H2'
_cod_database_code               9005317
Symmetry reduction of the aluminosilicate framework of LAU topology by ordering of exchangeable cations: the crystal structure of primary leonhardite with a primitive Bravais lattice
Baur, W. H.; Joswig, W.; Fursenko, B. A.; Belitsky, I. A.; European Journal of Mineralogy 9 (1997) 1173–1182; doi:

data_9005318
_publ_section_title
;Symmetry reduction of the aluminosilicate framework of LAU topology by
 ordering of exchangeable cations: the crystal structure of primary
 leonhardite with a primitive Bravais lattice
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              1173
_journal_page_last               1182
_journal_volume                  9
_journal_year                    1997
_chemical_formula_sum
'Al4.072 Ca1.276 H4.534 K0.795 Na0.62 O31 Si7.928'
_chemical_name_mineral           Leonhardite
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2ya'
_symmetry_space_group_name_H-M   'P 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 110.75
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   14.556
_cell_length_b                   13.206
_cell_length_c                   7.513
_cell_volume                     1350.520
_database_code_amcsd             0006703
_exptl_crystal_density_diffrn    2.285
_cod_original_formula_sum
'K.795 Na.62 Ca1.276 (Si7.928 Al4.072) O31 H4.534'
_cod_database_code               9005318
Cation site ordering in phengite 3T from the Dora-Maira massif (western Alps): a variable-temperature neutron powder diffraction study Note: at T = 293 K
Pavese, A.; Ferraris, G.; Prencipe, M.; Ibberson, R.; European Journal of Mineralogy 9 (1997) 1183–1190; doi:

data_9005319
_publ_section_title
;
 Cation site ordering in phengite 3T from the Dora-Maira
 massif (western Alps): a variable-temperature neutron
 powder diffraction study
 Note: at T = 293 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              1183
_journal_page_last               1190
_journal_volume                  9
_journal_year                    1997
_chemical_compound_source        'Dora-Maira massif, western Alps'
_chemical_formula_sum            'Al1.788 H2 K Mg0.64 O12 Si3.572'
_chemical_name_mineral           Aluminoceladonite
_space_group_IT_number           151
_symmetry_space_group_name_Hall  'P 31 2 (0 0 4)'
_symmetry_space_group_name_H-M   'P 31 1 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   5.21379
_cell_length_b                   5.21379
_cell_length_c                   29.7382
_cell_formula_units_Z            3
_cell_volume                     700.088
_database_code_amcsd             0006704
_diffrn_ambient_temperature      293
_exptl_crystal_density_diffrn    2.827
_cod_original_formula_sum        'K Al1.788 Mg.64 Si3.572 O12 H2'
_cod_database_code               9005319
Cation site ordering in phengite 3T from the Dora-Maira massif (western Alps): a variable-temperature neutron powder diffraction study Note: at T = 893 K
Pavese, A.; Ferraris, G.; Prencipe, M.; Ibberson, R.; European Journal of Mineralogy 9 (1997) 1183–1190; doi:

data_9005320
_publ_section_title
;
 Cation site ordering in phengite 3T from the Dora-Maira
 massif (western Alps): a variable-temperature neutron
 powder diffraction study
 Note: at T = 893 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              1183
_journal_page_last               1190
_journal_volume                  9
_journal_year                    1997
_chemical_compound_source        'Dora-Maira massif, western Alps'
_chemical_formula_sum            'Al2.798 H2 K2 Mg0.63 O12 Si3.572'
_chemical_name_mineral           Phengite
_space_group_IT_number           151
_symmetry_space_group_name_Hall  'P 31 2 (0 0 4)'
_symmetry_space_group_name_H-M   'P 31 1 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   5.23169
_cell_length_b                   5.23169
_cell_length_c                   30.1227
_cell_formula_units_Z            3
_cell_volume                     714.017
_database_code_amcsd             0006705
_diffrn_ambient_temperature      893
_exptl_crystal_density_diffrn    3.233
_cod_original_formula_sum        'K2 Al2.798 Mg.63 Si3.572 O12 H2'
_cod_database_code               9005320
Crystal structure of synthetic Pb4.32Sb3.68S8.68Cl2.32 A chlorine-bearing alternative to Pb4Sb4S11
Kostov-Kytin V V; Petrova, R.; Macicek, J.; European Journal of Mineralogy 9 (1997) 1191–1197; doi:

data_9005321
_publ_section_title
;
 Crystal structure of synthetic Pb4.32Sb3.68S8.68Cl2.32
 A chlorine-bearing alternative to Pb4Sb4S11
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              1191
_journal_page_last               1197
_journal_volume                  9
_journal_year                    1997
_chemical_formula_structural     Pb4.32Sb3.68S8.68Cl2.32
_chemical_formula_sum            'Cl2.3 Pb4.32 S8.7 Sb3.68'
_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_length_a                   15.04
_cell_length_b                   15.51
_cell_length_c                   4.09
_cell_formula_units_Z            2
_cell_volume                     954.076
_database_code_amcsd             0006706
_exptl_crystal_density_diffrn    5.930
_cod_original_formula_sum        'Pb4.32 Sb3.68 S8.7 Cl2.3'
_cod_database_code               9005321
_amcsd_formula_title             Pb4.32Sb3.68S8.68Cl2.32
Crystal structure of a carbonate-nosean Na8[AlSiO4]6CO3
Gesing, T. M.; Buhl, J.-C.; European Journal of Mineralogy 10 (1998) 71–77; doi:

data_9005322
_publ_section_title
;
 Crystal structure of a carbonate-nosean Na8[AlSiO4]6CO3
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              71
_journal_page_last               77
_journal_volume                  10
_journal_year                    1998
_chemical_formula_sum            'C Al6 Na8 O27 Si6'
_chemical_name_mineral           Nosean
_space_group_IT_number           195
_symmetry_space_group_name_Hall  'P 2 2 3'
_symmetry_space_group_name_H-M   'P 2 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   9.001
_cell_length_b                   9.001
_cell_length_c                   9.001
_cell_formula_units_Z            1
_cell_volume                     729.243
_database_code_amcsd             0006707
_exptl_crystal_density_diffrn    2.182
_cod_original_formula_sum        'Na8 Al6 Si6 C O27'
_cod_database_code               9005322
Crystal chemistry of the tsumcorite-group minerals. New data on ferrilotharmeyerite, tsumcorite, thometzekite, mounanaite, helmutwinklerite, and a redefinition of gartrellite
Krause, W.; Belendorff, K.; Bernhardt, H. J.; McCammon, C. A.; Effenberger, H.; Mikenda, W.; European Journal of Mineralogy 10 (1998) 179–206; doi:

data_9005323
_publ_section_title
;Crystal chemistry of the tsumcorite-group minerals. New data on
 ferrilotharmeyerite, tsumcorite, thometzekite, mounanaite, helmutwinklerite,
 and a redefinition of gartrellite
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              179
_journal_page_last               206
_journal_volume                  10
_journal_year                    1998
_chemical_compound_source        'Tsumeb mine, Namibia'
_chemical_formula_sum            'As2 Ca Fe0.994 H2 O10 Zn1.006'
_chemical_name_mineral           Ferrilotharmeyerite
_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                 115.52
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.010
_cell_length_b                   6.246
_cell_length_c                   7.391
_cell_volume                     375.358
_database_code_amcsd             0006708
_exptl_crystal_density_diffrn    4.187
_cod_original_formula_sum        'Ca (Fe.994 Zn1.006) As2 (O10 H2)'
_cod_database_code               9005323
Crystal chemistry of the tsumcorite-group minerals. New data on ferrilotharmeyerite, tsumcorite, thometzekite, mounanaite, helmutwinklerite, and a redefinition of gartrellite
Krause, W.; Belendorff, K.; Bernhardt, H. J.; McCammon, C. A.; Effenberger, H.; Mikenda, W.; European Journal of Mineralogy 10 (1998) 179–206; doi:

data_9005324
_publ_section_title
;Crystal chemistry of the tsumcorite-group minerals. New data on
 ferrilotharmeyerite, tsumcorite, thometzekite, mounanaite, helmutwinklerite,
 and a redefinition of gartrellite
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              179
_journal_page_last               206
_journal_volume                  10
_journal_year                    1998
_chemical_compound_source        'Tsumeb mine, Namibia'
_chemical_formula_sum            'As1.234 Cu2 H2 O10 Pb S0.766'
_chemical_name_mineral           Thometzekite
_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                 116.99
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.077
_cell_length_b                   6.300
_cell_length_c                   7.661
_cell_volume                     390.380
_database_code_amcsd             0006709
_exptl_crystal_density_diffrn    5.218
_cod_original_formula_sum        'Pb Cu2 (As1.234 S.766) (O10 H2)'
_cod_database_code               9005324
Crystal chemistry of the tsumcorite-group minerals. New data on ferrilotharmeyerite, tsumcorite, thometzekite, mounanaite, helmutwinklerite, and a redefinition of gartrellite
Krause, W.; Belendorff, K.; Bernhardt, H. J.; McCammon, C. A.; Effenberger, H.; Mikenda, W.; European Journal of Mineralogy 10 (1998) 179–206; doi:

data_9005325
_publ_section_title
;Crystal chemistry of the tsumcorite-group minerals. New data on
 ferrilotharmeyerite, tsumcorite, thometzekite, mounanaite, helmutwinklerite,
 and a redefinition of gartrellite
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              179
_journal_page_last               206
_journal_volume                  10
_journal_year                    1998
_chemical_formula_sum            'F2 Fe2 O8 Pb V2'
_chemical_name_mineral           Mounanaite
_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                 115.57
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.294
_cell_length_b                   6.166
_cell_length_c                   7.713
_cell_volume                     398.717
_exptl_crystal_density_diffrn    4.887
_cod_original_formula_sum        'Pb Fe2 V2 F2 O8'
_cod_database_code               9005325