LMucko/crystallography-open-database huggingface dataset:
The phases of natrolite occurring during dehydration and rehydration studied by single crystal X-ray diffraction methods between room temperature and 923 K Locality: Khibiny, Kola peninsula, Russia Sample: T = 573 K, crystal III, "high natrolite"
Baur, W. H.; Joswig, W.; Neues Jahrbuch fur Mineralogie, Monatshefte 1996 (1996) 171–187; doi:

data_9009400
_publ_section_title
;The phases of natrolite occurring during dehydration and rehydration studied
 by single crystal X-ray diffraction methods between room temperature and 923
 K Locality: Khibiny, Kola peninsula, Russia Sample: T = 573 K, crystal III,
 "high natrolite"
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              171
_journal_page_last               187
_journal_volume                  1996
_journal_year                    1996
_chemical_compound_source        'Khibiny, Kola peninsula, Russia'
_chemical_formula_sum            'Al2 Na2 O10 Si3'
_chemical_name_mineral           Natrolite
_space_group_IT_number           43
_symmetry_space_group_name_Hall  'F 2 -2d'
_symmetry_space_group_name_H-M   'F d d 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   17.328
_cell_length_b                   17.551
_cell_length_c                   6.385
_cell_formula_units_Z            8
_cell_volume                     1941.830
_database_code_amcsd             0014893
_diffrn_ambient_temperature      573
_exptl_crystal_density_diffrn    2.355
_cod_original_formula_sum        'Na2 Al2 Si3 O10'
_cod_database_code               9009400
The phases of natrolite occurring during dehydration and rehydration studied by single crystal X-ray diffraction methods between room temperature and 923 K Locality: Khibiny, Kola peninsula, Russia Sample: T = 293 K, crystal III, "postnatrolite"
Baur, W. H.; Joswig, W.; Neues Jahrbuch fur Mineralogie, Monatshefte 1996 (1996) 171–187; doi:

data_9009401
_publ_section_title
;The phases of natrolite occurring during dehydration and rehydration studied
 by single crystal X-ray diffraction methods between room temperature and 923
 K Locality: Khibiny, Kola peninsula, Russia Sample: T = 293 K, crystal III,
 "postnatrolite"
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              171
_journal_page_last               187
_journal_volume                  1996
_journal_year                    1996
_chemical_compound_source        'Khibiny, Kola peninsula, Russia'
_chemical_formula_sum            'Al2 H4 Na1.74 O11.5 Si3'
_chemical_name_mineral           Natrolite
_space_group_IT_number           43
_symmetry_space_group_name_Hall  'F 2 -2d'
_symmetry_space_group_name_H-M   'F d d 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   18.221
_cell_length_b                   18.331
_cell_length_c                   6.536
_cell_volume                     2183.084
_database_code_amcsd             0014894
_diffrn_ambient_temperature      293
_exptl_crystal_density_diffrn    2.229
_cod_original_formula_sum        'Na1.74 Al2 Si3 O11.5 H4'
_cod_database_code               9009401
Caoxite, Ca(H2O)3(C2O4), a new mineral from the Cerchiara mine, northern Apennines, Italy
Basso, R.; Lucchetti, G.; Zefiro, L.; Palenzona, A.; Neues Jahrbuch fur Mineralogie, Monatshefte 1997 (1997) 84–96; doi:

data_9009402
_publ_section_title
;
 Caoxite, Ca(H2O)3(C2O4), a new mineral from the Cerchiara mine,
 northern Apennines, Italy
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              84
_journal_page_last               96
_journal_volume                  1997
_journal_year                    1997
_chemical_compound_source
'Cerchiara mine, Val di Vara, northern Apennines, Italy'
_chemical_formula_sum            'C2 H6 Ca O7'
_chemical_name_mineral           Caoxite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                76.54
_cell_angle_beta                 70.30
_cell_angle_gamma                70.75
_cell_formula_units_Z            2
_cell_length_a                   6.097
_cell_length_b                   7.145
_cell_length_c                   8.434
_cell_volume                     323.495
_database_code_amcsd             0014895
_exptl_crystal_density_diffrn    1.870
_cod_original_formula_sum        'Ca C2 O7 H6'
_cod_database_code               9009402
X-ray single-crystal structure refinement of szenicsite, Cu3MoO4(OH)4, and its relation to the structure of antlerite, Cu3SO4(OH)4
Stolz, J.; Armbruster, T.; Neues Jahrbuch fur Mineralogie, Monatshefte 1998 (1998) 278–288; doi:

data_9009403
_publ_section_title
;
 X-ray single-crystal structure refinement of szenicsite, Cu3MoO4(OH)4,
 and its relation to the structure of antlerite, Cu3SO4(OH)4
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              278
_journal_page_last               288
_journal_volume                  1998
_journal_year                    1998
_chemical_compound_source
'Jardinera No. 1, Inca de Oro, Atacama, Chile'
_chemical_formula_sum            'Cu3 H4 Mo O8'
_chemical_name_mineral           Szenicsite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   12.559
_cell_length_b                   8.518
_cell_length_c                   6.072
_cell_formula_units_Z            4
_cell_volume                     649.568
_database_code_amcsd             0014897
_exptl_crystal_density_diffrn    4.280
_cod_original_formula_sum        'Cu3 Mo O8 H4'
_cod_database_code               9009403
Natural wulfenite: structural refinement by single-crystal X-ray diffraction
Lugli, C.; Medici, L.; Saccardo, D.; Neues Jahrbuch fur Mineralogie, Monatshefte 1999 (1999) 281–288; doi:

data_9009404
_publ_section_title
;
 Natural wulfenite: structural refinement by single-crystal X-ray diffraction
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              281
_journal_page_last               288
_journal_volume                  1999
_journal_year                    1999
_chemical_compound_source        'Monte Cengio, Vicenza, Italy'
_chemical_formula_sum            'Mo O4 Pb'
_chemical_name_mineral           Wulfenite
_space_group_IT_number           88
_symmetry_space_group_name_Hall  '-I 4ad'
_symmetry_space_group_name_H-M   'I 41/a :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.434
_cell_length_b                   5.434
_cell_length_c                   12.107
_cell_formula_units_Z            4
_cell_volume                     357.500
_database_code_amcsd             0014900
_exptl_crystal_density_diffrn    6.821
_cod_original_sg_symbol_H-M      'I 41/a'
_cod_original_formula_sum        'Pb Mo O4'
_cod_database_code               9009404
Single-crystal X-ray structure refinement of cornwallite, Cu5(AsO4)2(OH)4: A comparison with its polymorph cornubite and the (PO4)-analogue pseudomalachite Locality: Clara mine, Oberwolfach, Black Forest, Germany Note: Biso for O2 and O4 switched to match calculated values
Arlt, T.; Armbruster, T.; Neues Jahrbuch fur Mineralogie, Monatshefte 1999 (1999) 468–480; doi:

data_9009405
_publ_section_title
;Single-crystal X-ray structure refinement of cornwallite, Cu5(AsO4)2(OH)4: A
 comparison with its polymorph cornubite and the (PO4)-analogue
 pseudomalachite Locality: Clara mine, Oberwolfach, Black Forest, Germany
 Note: Biso for O2 and O4 switched to match calculated values
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              468
_journal_page_last               480
_journal_volume                  1999
_journal_year                    1999
_chemical_compound_source
'Clara mine, Oberwolfach, Black Forest, Germany'
_chemical_formula_sum            'As1.8 Cu5 H4 O12 P0.2'
_chemical_name_mineral           Cornwallite
_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                 91.87
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.600
_cell_length_b                   5.757
_cell_length_c                   17.380
_cell_volume                     460.016
_database_code_amcsd             0014901
_exptl_crystal_density_diffrn    4.727
_cod_original_cell_volume        460.015
_cod_original_formula_sum        'Cu5 (As1.8 P.2) O12 H4'
_cod_database_code               9009405
Cerchiaraite, a new natural Ba-Mn-mixed-anion silicate chloride from the Cerchiara mine, northern Apennines, Italy
Basso, R.; Lucchetti, G.; Zefiro, L.; Palenzona, A.; Neues Jahrbuch fur Mineralogie, Monatshefte 2000 (2000) 373–384; doi:

data_9009406
_publ_section_title
;
 Cerchiaraite, a new natural Ba-Mn-mixed-anion silicate chloride from
 the Cerchiara mine, northern Apennines, Italy
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              373
_journal_page_last               384
_journal_volume                  2000
_journal_year                    2000
_chemical_compound_source
'Cerchiara mine, Va di Vara, northern Apennines, Italy'
_chemical_formula_sum            'Ba4 Cl Mn4 O25 Si6'
_chemical_name_mineral           Cerchiaraite
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   14.215
_cell_length_b                   14.215
_cell_length_c                   6.126
_cell_formula_units_Z            2
_cell_volume                     1237.858
_database_code_amcsd             0014905
_exptl_crystal_density_diffrn    3.684
_cod_original_formula_sum        'Ba4 Mn4 Si6 Cl O25'
_cod_database_code               9009406
Zincowoodwardite, [Zn1-x Alx(OH)2][(SO4)x/2(H2O)n], a new mineral of the hydrotalcite group Locality: Hilarion mine, Kamariza, near Laurion, Greece Note: polytype Zincowoodwardite-1T
Witzke, T.; Raade, G.; Neues Jahrbuch fur Mineralogie, Monatshefte 2000 (2000) 455–465; doi:

data_9009407
_publ_section_title
;Zincowoodwardite, [Zn1-x Alx(OH)2][(SO4)x/2(H2O)n], a new mineral of the
 hydrotalcite group Locality: Hilarion mine, Kamariza, near Laurion, Greece
 Note: polytype Zincowoodwardite-1T
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              455
_journal_page_last               465
_journal_volume                  2000
_journal_year                    2000
_chemical_compound_source        'Hilarion mine, Kamariza, near Laurion, Greece'
_chemical_formula_sum            'Al0.375 H6 O2.686 S0.188 Zn0.625'
_chemical_name_mineral           Zincowoodwardite
_space_group_IT_number           147
_symmetry_space_group_name_Hall  '-P 3'
_symmetry_space_group_name_H-M   'P -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   3.063
_cell_length_b                   3.063
_cell_length_c                   8.91
_cell_volume                     72.394
_database_code_amcsd             0014907
_exptl_crystal_density_diffrn    2.432
_cod_original_formula_sum        '(Zn.625 Al.375) S.188 O2.686 H6'
_cod_database_code               9009407
Zincowoodwardite, [Zn1-x Alx(OH)2][(SO4)x/2(H2O)n], a new mineral of the hydrotalcite group Locality: Hilarion mine, Kamariza, near Laurion, Greece
Witzke T; Raade G; Neues Jahrbuch fur Mineralogie, Monatshefte 2000 (2000) 455–465; doi:

data_9009408
_publ_section_title
;Zincowoodwardite, [Zn1-x Alx(OH)2][(SO4)x/2(H2O)n], a new mineral of the
 hydrotalcite group Locality: Hilarion mine, Kamariza, near Laurion, Greece
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              455
_journal_page_last               465
_journal_volume                  2000
_journal_year                    2000
_chemical_formula_sum            'Al0.375 H9 O2.692 S0.188 Zn0.625'
_chemical_name_mineral           Zincowoodwardite-3R
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   3.065
_cell_length_b                   3.065
_cell_length_c                   25.42
_cell_formula_units_Z            3
_cell_volume                     206.808
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        '(Zn.625 Al.375) S.188 O2.692 H9'
_cod_database_code               9009408
Gottlobite, CaMg(VO4,AsO4)(OH), a new mineral from Friedrichroda, Thuringia, Germany Locality: Glucksstern min, Gottlob hill, Friedrichroda, Thuringia, Germany
Witzke, T.; Steins, M.; Doering, T.; Kolitsch, U.; Neues Jahrbuch fur Mineralogie, Monatshefte 2000 (2000) 444–454; doi:

data_9009409
_publ_section_title
;Gottlobite, CaMg(VO4,AsO4)(OH), a new mineral from Friedrichroda, Thuringia,
 Germany Locality: Glucksstern min, Gottlob hill, Friedrichroda, Thuringia,
 Germany
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              444
_journal_page_last               454
_journal_volume                  2000
_journal_year                    2000
_chemical_compound_source
'Glucksstern min, Gottlob hill, Friedrichroda, Thuringia, Germany'
_chemical_formula_sum            'As0.25 Ca H Mg O5 V0.75'
_chemical_name_mineral           Gottlobite
_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_formula_units_Z            4
_cell_length_a                   7.510
_cell_length_b                   9.004
_cell_length_c                   5.948
_cell_volume                     402.204
_database_code_amcsd             0014906
_exptl_crystal_density_diffrn    3.341
_cod_original_formula_sum        'Ca Mg (V.75 As.25) (O5 H)'
_cod_database_code               9009409
Low-temperature Ni-rich lollingite from Haje, Pibram, Czech Republic. Rietveld crystal structure refinement
Ondrus, P.; Vavrin, I.; Skala, R.; Veselovsky, F.; Neues Jahrbuch fur Mineralogie, Monatshefte 2001 (2001) 169–185; doi:

data_9009410
_publ_section_title
;
 Low-temperature Ni-rich lollingite from Haje, Pibram, Czech Republic.
 Rietveld crystal structure refinement
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              169
_journal_page_last               185
_journal_volume                  2001
_journal_year                    2001
_chemical_compound_source        'Haje, Pibram, Czech Republic'
_chemical_formula_sum            'As1.94 Co0.03 Fe0.61 Ni0.36 S0.02 Sb0.04'
_chemical_name_mineral           Lollingite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.243
_cell_length_b                   5.978
_cell_length_c                   2.9783
_cell_formula_units_Z            2
_cell_volume                     93.348
_database_code_amcsd             0014909
_exptl_crystal_density_diffrn    7.394
_cod_original_formula_sum        '(Fe.61 Ni.36 Co.03) (As1.94 Sb.04 S.02)'
_cod_database_code               9009410
Low-temperature Ni-rich lollingite from Haje, Pibram, Czech Republic. Rietveld crystal structure refinement
Ondrus, P.; Vavrin, I.; Skala, R.; Veselovsky, F.; Neues Jahrbuch fur Mineralogie, Monatshefte 2001 (2001) 169–185; doi:

data_9009411
_publ_section_title
;
 Low-temperature Ni-rich lollingite from Haje, Pibram, Czech Republic.
 Rietveld crystal structure refinement
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              169
_journal_page_last               185
_journal_volume                  2001
_journal_year                    2001
_chemical_compound_source        'Dolni Bory, Czech Republic'
_chemical_formula_sum            'As2 Fe'
_chemical_name_mineral           Lollingite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.2684
_cell_length_b                   5.9631
_cell_length_c                   2.9007
_cell_formula_units_Z            2
_cell_volume                     91.128
_database_code_amcsd             0014910
_exptl_crystal_density_diffrn    7.496
_cod_original_formula_sum        'Fe As2'
_cod_database_code               9009411
The crystal structure of natural gugiaite, Ca2BeSi2O7 Locality: skarn rocks in the Gugia alkaline complex, Liaoning Province, China Note, z coordinate of Ca is altered to reproduce reported Ca-O bond lengths
Yang, Z.; Fleck, M.; Pertlik, F.; Tillmanns, E.; Tao, K.; Neues Jahrbuch fur Mineralogie, Monatshefte 2001 (2001) 186–192; doi:

data_9009412
_publ_section_title
;The crystal structure of natural gugiaite, Ca2BeSi2O7 Locality: skarn rocks
 in the Gugia alkaline complex, Liaoning Province, China Note, z coordinate of
 Ca is altered to reproduce reported Ca-O bond lengths
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              186
_journal_page_last               192
_journal_volume                  2001
_journal_year                    2001
_chemical_compound_source
'skarn rocks in the Gugia alkaline complex, Liaoning Province, China'
_chemical_formula_sum            'Be Ca2 O7 Si2'
_chemical_name_mineral           Gugiaite
_space_group_IT_number           113
_symmetry_space_group_name_Hall  'P -4 2ab'
_symmetry_space_group_name_H-M   'P -4 21 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.4330
_cell_length_b                   7.4330
_cell_length_c                   4.9970
_cell_formula_units_Z            2
_cell_volume                     276.082
_database_code_amcsd             0014911
_exptl_crystal_density_diffrn    3.096
_cod_original_formula_sum        'Ca2 Be Si2 O7'
_cod_database_code               9009412
Damaraite, Pb3O2(OH)Cl: crystal structure and new chemical formula
Keller, P.; Lissner, F.; Schleid, T.; Neues Jahrbuch fur Mineralogie, Monatshefte 2001 (2001) 326–336; doi:

data_9009413
_publ_section_title
;
 Damaraite, Pb3O2(OH)Cl: crystal structure and new chemical formula
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              326
_journal_page_last               336
_journal_volume                  2001
_journal_year                    2001
_chemical_compound_source        'Kombat mine, Namibia'
_chemical_formula_sum            'Cl H O3 Pb3'
_chemical_name_mineral           Damaraite
_space_group_IT_number           26
_symmetry_space_group_name_Hall  'P 2c -2'
_symmetry_space_group_name_H-M   'P m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.813
_cell_length_b                   6.921
_cell_length_c                   15.192
_cell_volume                     611.201
_database_code_amcsd             0014912
_exptl_crystal_density_diffrn    7.673
_cod_original_formula_sum        'Pb3 O3 Cl H'
_cod_database_code               9009413
Ancylite-(La) from the Ilimaussaq alkaline complex, South Greenland
Petersen O V; Niedermayr G; Gault R A; Brandstatter F; Micheelsen H I; Giester G; Neues Jahrbuch fur Mineralogie, Monatshefte 2001 (2001) 493–504; doi:

data_9009414
_publ_section_title
;
 Ancylite-(La) from the Ilimaussaq alkaline complex, South Greenland
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              493
_journal_page_last               504
_journal_volume                  2001
_journal_year                    2001
_chemical_compound_source
'Ilimaussaq alkaline complex, South Greenland'
_chemical_formula_sum
'C H3 Ca0.05 Ce0.04 F0.075 La0.27 Nd0.205 O3.925 Pr0.07 Sm0.01 Sr0.31'
_chemical_name_mineral           Ancylite-(La)
_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_formula_units_Z            4
_cell_length_a                   5.044
_cell_length_b                   8.541
_cell_length_c                   7.292
_cell_volume                     314.145
_database_code_amcsd             0014913
_exptl_crystal_density_diffrn    4.036
_cod_original_formula_sum
'Sr.31 Ca.05 La.27 Nd.205 Pr.07 Ce.04 Sm.01 C O3.925 F.075 H3'
_cod_database_code               9009414
Crystal chemistry of a manganian ludwigite Note: z-coordinate has been altered through personal communication with the author Locality: Jakobsberg Fe-Mn oxide deposit, Filipstad, Varmland, Sweden
Holtstam, D.; Neues Jahrbuch fur Mineralogie, Monatshefte 2001 (2001) 520–528; doi:

data_9009415
_publ_section_title
;Crystal chemistry of a manganian ludwigite Note: z-coordinate has been
 altered through personal communication with the author Locality: Jakobsberg
 Fe-Mn oxide deposit, Filipstad, Varmland, Sweden
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              520
_journal_page_last               528
_journal_volume                  2001
_journal_year                    2001
_chemical_compound_source
'Jakobsberg Fe-Mn oxide deposit, Filipstad, Varmland, Sweden'
_chemical_formula_sum            'Al0.44 B2 Fe1.11 Mg3.91 Mn0.54 O10'
_chemical_name_mineral           Ludwigite
_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                   9.240
_cell_length_b                   12.362
_cell_length_c                   2.9869
_cell_formula_units_Z            2
_cell_volume                     341.178
_database_code_amcsd             0014914
_exptl_crystal_density_diffrn    3.701
_cod_original_formula_sum        'Mg3.91 Fe1.11 Mn.54 Al.44 B2 O10'
_cod_database_code               9009415