LMucko/crystallography-open-database huggingface dataset:
Static disorders of atoms and experimental determination of Debye temperature in pyrope: Low- and high-temperature single-crystal X-ray diffraction study Note: T = 122.3 K
Nakatsuka, A.; Shimokawa, M.; Nakayama, N.; Ohtaka, O.; Arima, H.; Okube, M.; Yoshiasa, A.; American Mineralogist 96 (2011) 1593–1605; doi:10.2138/am.2011.3714

data_9014512
_publ_section_title
;
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 122.3 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1593
_journal_page_last               1605
_journal_paper_doi               10.2138/am.2011.3714
_journal_volume                  96
_journal_year                    2011
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Al2 Mg3 O12 Si3'
_chemical_name_mineral           Pyrope
_space_group_IT_number           230
_symmetry_space_group_name_Hall  '-I 4bd 2c 3'
_symmetry_space_group_name_H-M   'I a -3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   11.4425
_cell_length_b                   11.4425
_cell_length_c                   11.4425
_cell_formula_units_Z            8
_cell_volume                     1498.176
_database_code_amcsd             0018537
_exptl_crystal_density_diffrn    3.575
_cod_original_formula_sum        'Mg3 Al2 Si3 O12'
_cod_database_code               9014512
Structural changes induced by cation ordering in ferrotapiolite Note: Crystal Kim9_q3, treated at 750 C for 180 min
Zema, M.; Tarantino, S. C.; Giorgiani, A.; Mineralogical Magazine 70 (2006) 319–328; doi:10.1180/0026461067030335

data_9014513
_publ_section_title
;
 Structural changes induced by cation ordering in ferrotapiolite
 Note: Crystal Kim9_q3, treated at 750 C for 180 min
;
_journal_name_full               'Mineralogical Magazine'
_journal_page_first              319
_journal_page_last               328
_journal_paper_doi               10.1180/0026461067030335
_journal_volume                  70
_journal_year                    2006
_chemical_compound_source        'Kimito, Finland'
_chemical_formula_sum            'Fe Nb0.13 O6 Ta1.87'
_chemical_name_mineral           Tapiolite-(Fe)
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.7504
_cell_length_b                   4.7504
_cell_length_c                   9.2549
_cell_formula_units_Z            2
_cell_volume                     208.849
_database_code_amcsd             0018706
_exptl_crystal_density_diffrn    7.987
_cod_original_formula_sum        'Fe Ta1.87 Nb.13 O6'
_cod_database_code               9014513
The crystal structure of Cerussite _cod_database_code 1010956
Colby, M.; LaCoste, L.; Zeitschrift fur Kristallographie 84 (1933) 299–309; doi:

data_9014514
_publ_section_title
;
 The crystal structure of Cerussite
 _cod_database_code 1010956
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              299
_journal_page_last               309
_journal_volume                  84
_journal_year                    1933
_chemical_formula_sum            'C O2 Pb'
_chemical_name_mineral           Cerussite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2n 2a'
_symmetry_space_group_name_H-M   'P m c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.166
_cell_length_b                   8.468
_cell_length_c                   6.146
_cell_formula_units_Z            8
_cell_volume                     268.861
_database_code_amcsd             0017676
_exptl_crystal_density_diffrn    12.412
_cod_duplicate_entry             1010956
_cod_original_formula_sum        'Pb C O2'
_cod_database_code               9014514
Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide
Thorogood, G. J.; Avdeev, M.; Kennedy, B. J.; Solid State Sciences 12 (2010) 1263–1269; doi:10.1016/j.solidstatesciences.2010.02.036

data_9014515
_publ_section_title
;
 Structural studies of the aeschynite-euxenite transformation in
 the series Ln(TiTa)O6 Ln = lanthanide
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              1263
_journal_page_last               1269
_journal_paper_doi               10.1016/j.solidstatesciences.2010.02.036
_journal_volume                  12
_journal_year                    2010
_chemical_compound_source        Synthetic
_chemical_formula_sum            'O6 Pr Ta Ti'
_chemical_name_mineral           Tantalaeschynite-(Pr)
_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                   10.9511
_cell_length_b                   7.5288
_cell_length_c                   5.3829
_cell_formula_units_Z            4
_cell_volume                     443.813
_database_code_amcsd             0018925
_exptl_crystal_density_diffrn    6.970
_cod_original_formula_sum        'Pr (Ta Ti) O6'
_cod_database_code               9014515
The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy Note: theoretical structure, GGA from Pnam
Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S.; American Mineralogist 97 (2012) 1043–1048; doi:10.2138/am.2012.4022

data_9014516
_publ_section_title
;
 The 3.65 A phase, MgSi(OH)6: structural insights from
 DFT-calculations and T-dependent IR spectroscopy
 Note: theoretical structure, GGA from Pnam
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1043
_journal_page_last               1048
_journal_paper_doi               10.2138/am.2012.4022
_journal_volume                  97
_journal_year                    2012
_chemical_formula_sum            'H6 Mg O6 Si'
_space_group_IT_number           4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 89.88
_cell_angle_gamma                90
_cell_length_a                   5.148
_cell_length_b                   5.252
_cell_length_c                   7.404
_cell_formula_units_Z            2
_cell_volume                     200.184
_database_code_amcsd             0019160
_exptl_crystal_density_diffrn    2.562
_cod_original_formula_sum        'Mg Si O6 H6'
_cod_database_code               9014516
_amcsd_formula_title             MgSi(OH)6
Ordered magnetic frustration: XVI.Magnetic structure of CsCoF4 at 1.5 K _cod_database_code 1000491
Lacorre, P.; Pannetier, J.; Fleischer, T.; Hoppe, R.; Ferey, G.; Journal of Solid State Chemistry 93 (1991) 37–45; doi:10.1016/0022-4596(91)90271-I

data_9014517
_publ_section_title
;
 Ordered magnetic frustration: XVI.Magnetic structure of CsCoF4 at 1.5 K
 _cod_database_code 1000491
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              37
_journal_page_last               45
_journal_paper_doi               10.1016/0022-4596(91)90271-I
_journal_volume                  93
_journal_year                    1991
_chemical_formula_sum            'Co5 Cs5 F20'
_space_group_IT_number           120
_symmetry_space_group_name_Hall  'I -4 -2c'
_symmetry_space_group_name_H-M   'I -4 c 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   12.4353
_cell_length_b                   12.4353
_cell_length_c                   12.8612
_cell_formula_units_Z            4
_cell_volume                     1988.813
_database_code_amcsd             0013719
_exptl_crystal_density_diffrn    4.472
_cod_duplicate_entry             1000491
_cod_original_formula_sum        'Cs5 Co5 F20'
_cod_database_code               9014517
_amcsd_formula_title             CsCoF4
Static disorders of atoms and experimental determination of Debye temperature in pyrope: Low- and high-temperature single-crystal X-ray diffraction study Note: T = 173.7 K
Nakatsuka, A.; Shimokawa, M.; Nakayama, N.; Ohtaka, O.; Arima, H.; Okube, M.; Yoshiasa, A.; American Mineralogist 96 (2011) 1593–1605; doi:10.2138/am.2011.3714

data_9014518
_publ_section_title
;
 Static disorders of atoms and experimental determination of Debye temperature in
 pyrope: Low- and high-temperature single-crystal X-ray diffraction study
 Note: T = 173.7 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1593
_journal_page_last               1605
_journal_paper_doi               10.2138/am.2011.3714
_journal_volume                  96
_journal_year                    2011
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Al2 Mg3 O12 Si3'
_chemical_name_mineral           Pyrope
_space_group_IT_number           230
_symmetry_space_group_name_Hall  '-I 4bd 2c 3'
_symmetry_space_group_name_H-M   'I a -3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   11.4450
_cell_length_b                   11.4450
_cell_length_c                   11.4450
_cell_formula_units_Z            8
_cell_volume                     1499.158
_database_code_amcsd             0018538
_exptl_crystal_density_diffrn    3.572
_cod_original_formula_sum        'Mg3 Al2 Si3 O12'
_cod_database_code               9014518
Volaschioite, Fe3+4(SO4)O2(OH)6*2H20, a new mineral species from Fornovolasco, Apuan Alps, Tuscany, Italy
Biagioni, C.; Bonaccorsi, E.; Orlandi, P.; The Canadian Mineralogist 49 (2011) 605–614; doi:10.3749/canmin.49.2.605

data_9014519
_publ_section_title
;
 Volaschioite, Fe3+4(SO4)O2(OH)6*2H20, a new mineral species
 from Fornovolasco, Apuan Alps, Tuscany, Italy
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              605
_journal_page_last               614
_journal_paper_doi               10.3749/canmin.49.2.605
_journal_volume                  49
_journal_year                    2011
_chemical_compound_source        'Fornovolasco, Tuscany, Italy'
_chemical_formula_sum            'Fe2 H5 O7 S0.5'
_chemical_name_mineral           Volaschioite
_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                 93.82
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   16.068
_cell_length_b                   3.058
_cell_length_c                   10.929
_cell_volume                     535.814
_database_code_amcsd             0018472
_exptl_crystal_density_diffrn    3.034
_cod_depositor_comments
;
         Z inserted to be consistent with given formula
        Water oxygen atoms renamed so that they are treated as oxygens
                                          miguel
;
_cod_original_formula_sum        'Fe2 S.5 O7 H5'
_cod_database_code               9014519
X-ray study of the average structures of Cu2Se and Cu1.8S in the room temperature and the high temperature phases Note: Sample: Cu2Se (low), T = 300 K
Yamamoto, K.; Kashida, S.; Journal of Solid State Chemistry 93 (1991) 202–211; doi:10.1016/0022-4596(91)90289-T

data_9014520
_publ_section_title
;
 X-ray study of the average structures of Cu2Se and Cu1.8S in the
 room temperature and the high temperature phases
 Note: Sample: Cu2Se (low), T = 300 K
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              202
_journal_page_last               211
_journal_paper_doi               10.1016/0022-4596(91)90289-T
_journal_volume                  93
_journal_year                    1991
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Cu2 Se'
_chemical_name_mineral           Berzelianite
_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_length_a                   5.694
_cell_length_b                   5.694
_cell_length_c                   5.694
_cell_formula_units_Z            4
_cell_volume                     184.609
_database_code_amcsd             0019147
_exptl_crystal_density_diffrn    7.414
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9014520
Structural changes induced by cation ordering in ferrotapiolite Note: Crystal Kim24_q0, untreated
Zema, M.; Tarantino, S. C.; Giorgiani, A.; Mineralogical Magazine 70 (2006) 319–328; doi:10.1180/0026461067030335

data_9014521
_publ_section_title
;
 Structural changes induced by cation ordering in ferrotapiolite
 Note: Crystal Kim24_q0, untreated
;
_journal_name_full               'Mineralogical Magazine'
_journal_page_first              319
_journal_page_last               328
_journal_paper_doi               10.1180/0026461067030335
_journal_volume                  70
_journal_year                    2006
_chemical_compound_source        'Kimito, Finland'
_chemical_formula_sum            'Fe Nb0.13 O6 Ta1.87'
_chemical_name_mineral           Tapiolite-(Fe)
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.7562
_cell_length_b                   4.7562
_cell_length_c                   9.2910
_cell_formula_units_Z            2
_cell_volume                     210.176
_database_code_amcsd             0018722
_exptl_crystal_density_diffrn    7.937
_cod_original_formula_sum        'Fe Ta1.87 Nb.13 O6'
_cod_database_code               9014521
A series of Mixed-valent Molybdenum Monophosphates, Isotypic with Leucophosphite Represented by CsMo2P2O10 and K1.5Mo2P2O10.H2O _cod_database_code 1001553
Guesdon, A.; Borel, M.; Leclaire, A.; Grandin, A.; Raveau, B.; Zeitschrift fur Anorganische und Allgemeine Chemie 619 (1993) 1841–1849; doi:

data_9014522
_publ_section_title
;
 A series of Mixed-valent Molybdenum Monophosphates, Isotypic with
 Leucophosphite Represented by CsMo2P2O10 and
 K1.5Mo2P2O10.H2O
 _cod_database_code 1001553
;
_journal_name_full
'Zeitschrift fur Anorganische und Allgemeine Chemie'
_journal_page_first              1841
_journal_page_last               1849
_journal_volume                  619
_journal_year                    1993
_chemical_formula_sum            'Cs0.5 Mo O5 P'
_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                 127.38
_cell_angle_gamma                90
_cell_length_a                   9.428
_cell_length_b                   9.943
_cell_length_c                   12.348
_cell_formula_units_Z            8
_cell_volume                     919.807
_database_code_amcsd             0015801
_exptl_crystal_density_diffrn    3.948
_cod_original_formula_sum        'Mo Cs.5 P O5'
_cod_database_code               9014522
_amcsd_formula_title             'Cs Mo2 O10 P2'
_cod_duplicate_entry 1001553
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L24, ordered model
Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.; The Canadian Mineralogist 49 (2011) 63–88; doi:10.3749/canmin.49.1.63

data_9014523
_publ_section_title
;
 Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
 I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
 Sample: L24, ordered model
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              63
_journal_page_last               88
_journal_paper_doi               10.3749/canmin.49.1.63
_journal_volume                  49
_journal_year                    2011
_chemical_compound_source        'Anjanabonoina, central Madagascar'
_chemical_formula_sum
'Al7.293 B3 Ca0.684 F0.712 Fe0.039 H3.288 Li1.62 Mn0.048 Na0.238 O30.288 Pb0.013 Si6'
_chemical_name_mineral           Fluor-liddicoatite
_space_group_IT_number           160
_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_length_a                   15.8286
_cell_length_b                   15.8286
_cell_length_c                   7.1012
_cell_formula_units_Z            3
_cell_volume                     1540.804
_database_code_amcsd             0018442
_exptl_crystal_density_diffrn    3.074
_cod_original_sg_symbol_H-M      'R 3 m'
_cod_original_formula_sum
'Ca.684 Na.238 Pb.013 Al7.293 Fe.039 Mn.048 Li1.62 Si6 B3 F.712 O30.288 H3.288'
_cod_database_code               9014523
Temperature dependence of the structural parameters in the transformation of aragonite to calcite, as determined from in situ synchrotron powder X-ray-diffraction data Note: T = 599 C Note: P = 101 kPa
Antao, S. M.; Hassan, I.; The Canadian Mineralogist 48 (2010) 1225–1236; doi:10.3749/canmin.48.5.1225

data_9014524
_publ_section_title
;
 Temperature dependence of the structural parameters
 in the transformation of aragonite to calcite,
 as determined from in situ synchrotron powder X-ray-diffraction data
 Note: T = 599 C
 Note: P = 101 kPa
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              1225
_journal_page_last               1236
_journal_paper_doi               10.3749/canmin.48.5.1225
_journal_volume                  48
_journal_year                    2010
_chemical_compound_source        'Cuenca, Spain'
_chemical_formula_sum            'C Ca O3'
_chemical_name_mineral           Calcite
_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                   4.9766
_cell_length_b                   4.9766
_cell_length_c                   17.3757
_cell_formula_units_Z            6
_cell_volume                     372.682
_database_code_amcsd             0017864
_exptl_crystal_density_diffrn    2.676
_cod_original_sg_symbol_H-M      'R -3 c'
_cod_original_formula_sum        'Ca C O3'
_cod_database_code               9014524
Crystal chemistry of Mn2±, Sr-rich and REE-bearing piemontite from the Kamisugai mine in the Sambagawa metamorphic belt, Shikoku, Japan
Nagashima, M.; Armbruster, T.; Akasaka, M.; Minakawa, T.; Journal of Mineralogical and Petrological Sciences 105 (2010) 142–150; doi:10.2465/jmps.090709

data_9014525
_publ_section_title
;
 Crystal chemistry of Mn2+-, Sr-rich and REE-bearing piemontite from the
 Kamisugai mine in the Sambagawa metamorphic belt, Shikoku, Japan
;
_journal_name_full
'Journal of Mineralogical and Petrological Sciences'
_journal_page_first              142
_journal_page_last               150
_journal_paper_doi               10.2465/jmps.090709
_journal_volume                  105
_journal_year                    2010
_chemical_compound_source
'Kamisugai mine, Sambagawa metamorphic belt, Shikoku, Japan'
_chemical_formula_sum
'Al1.83 Ca1.3 Ce0.05 Fe1.11 H0.87 La0.03 Mn1.13 Nd0.02 O12.87 Si3 Sr0.19'
_chemical_name_mineral           Piemontite
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 114.719
_cell_angle_gamma                90
_cell_length_a                   8.8673
_cell_length_b                   5.6747
_cell_length_c                   10.1594
_cell_formula_units_Z            2
_cell_volume                     464.371
_database_code_amcsd             0018299
_exptl_crystal_density_diffrn    3.914
_cod_original_formula_sum
'Ca1.3 Mn1.13 Sr.19 La.03 Ce.05 Nd.02 Al1.83 Fe1.11 Si3 O12.87 H.87'
_cod_database_code               9014525
Kinetics of cation ordering in synthetic Mg(Al,Fe3+)2O4 spinels Note Sample F39, disordered at 1000 C for 24 h, then ordered at 550 C Annealing time = 5340 min
Princivalle, F.; Martignago, F.; Nestola, F.; Dal Negro, A.; European Journal of Mineralogy 24 (2012) 633–643; doi:10.1127/0935-1221/2012/0024-2223

data_9014526
_publ_section_title
;
 Kinetics of cation ordering in synthetic Mg(Al,Fe3+)2O4 spinels
 Note Sample F39, disordered at 1000 C for 24 h, then ordered at 550 C
 Annealing time = 5340 min
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              633
_journal_page_last               643
_journal_paper_doi               10.1127/0935-1221/2012/0024-2223
_journal_volume                  24
_journal_year                    2012
_chemical_formula_sum            'Al1.61 Fe0.392 Mg1.001 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                   8.1457
_cell_length_b                   8.1457
_cell_length_c                   8.1457
_cell_formula_units_Z            8
_cell_volume                     540.487
_database_code_amcsd             0019276
_exptl_crystal_density_diffrn    3.777
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_original_formula_sum        'Al1.61 Mg1.001 Fe.392 O4'
_cod_database_code               9014526
Crystal chemistry of cyclo-hexaphosphates. I. Structure of anhydrous potassium cyclo-hexaphosphate _cod_database_code 1008428
Averbuch-Pouchot M; Acta Crystallographica, Section C 45 (1989) 1273–1275; doi:10.1107/S0108270189000946

data_9014527
_publ_section_title
;
 Crystal chemistry of cyclo-hexaphosphates. I. Structure of anhydrous
 potassium cyclo-hexaphosphate
 _cod_database_code 1008428
;
_journal_name_full               'Acta Crystallographica, Section C'
_journal_page_first              1273
_journal_page_last               1275
_journal_paper_doi               10.1107/S0108270189000946
_journal_volume                  45
_journal_year                    1989
_chemical_formula_sum            'K O3 P'
_space_group_IT_number           205
_symmetry_space_group_name_Hall  '-P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P a -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   15.753
_cell_length_b                   15.753
_cell_length_c                   15.753
_cell_formula_units_Z            48
_cell_volume                     3909.217
_database_code_amcsd             0016335
_exptl_crystal_density_diffrn    2.407
_cod_duplicate_entry             1008428
_cod_original_cell_volume        3909.218
_cod_original_sg_symbol_H-M      'P a 3'
_cod_original_formula_sum        'K P O3'
_cod_database_code               9014527
_amcsd_formula_title             'K6 O18 P6'