LMucko/crystallography-open-database huggingface dataset:
SrNi3(P2O7)2
Bolte, M.; Acta Crystallographica, Section E 57 (2001) i30–i31; doi:10.1107/S1600536801005700

data_9007897
_publ_section_title
;
 SrNi3(P2O7)2
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i30
_journal_page_last               i31
_journal_paper_doi               10.1107/S1600536801005700
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     SrNi3(P2O7)2
_chemical_formula_sum            'Ni3 O14 P4 Sr'
_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                 112.194
_cell_angle_gamma                90
_cell_length_a                   7.4116
_cell_length_b                   7.6542
_cell_length_c                   9.4486
_cell_formula_units_Z            2
_cell_volume                     496.304
_database_code_amcsd             0010355
_exptl_crystal_density_diffrn    4.092
_cod_original_formula_sum        'Sr Ni3 P4 O14'
_cod_database_code               9007897
_amcsd_formula_title             SrNi3(P2O7)2
Trigonal Na4[UO2(CO3)3] Note: synthetic polymorph of cejkaite
Cisarova, I.; Skala, R.; Ondrus, P.; Drabek, M.; Acta Crystallographica, Section E 57 (2001) i32–i34; doi:10.1107/S1600536801005992

data_9007898
_publ_section_title
;
 Trigonal Na4[UO2(CO3)3]
 Note: synthetic polymorph of cejkaite
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i32
_journal_page_last               i34
_journal_paper_doi               10.1107/S1600536801005992
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     Na4[UO2(CO3)3]
_chemical_formula_sum            'C3 Na4 O11 U'
_space_group_IT_number           165
_symmetry_space_group_name_Hall  '-P 3 2"c'
_symmetry_space_group_name_H-M   'P -3 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   9.3380
_cell_length_b                   9.3380
_cell_length_c                   12.8170
_cell_formula_units_Z            4
_cell_volume                     967.887
_database_code_amcsd             0010356
_exptl_crystal_density_diffrn    3.720
_cod_original_formula_sum        'Na4 U C3 O11'
_cod_database_code               9007898
_amcsd_formula_title             Na4[UO2(CO3)3]
Hexagonal ErMnO3
Van Aken, B. B.; Meetsma, A.; Palstra, T. T. M.; Acta Crystallographica, Section E 57 (2001) i38–i40; doi:10.1107/S160053680100811X

data_9007899
_publ_section_title
;
 Hexagonal ErMnO3
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i38
_journal_page_last               i40
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     ErMnO3
_chemical_formula_sum            'Er Mn O3'
_space_group_IT_number           185
_symmetry_space_group_name_Hall  'P 6c -2'
_symmetry_space_group_name_H-M   'P 63 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   6.1121
_cell_length_b                   6.1121
_cell_length_c                   11.4200
_cell_formula_units_Z            6
_cell_volume                     369.469
_exptl_crystal_density_diffrn    7.286
_cod_database_code               9007899
_journal_paper_doi 10.1107/S160053680100811X
_cod_duplicate_entry 2200261
A powder diffraction study of Sr3Al10SiO20
Kubota, S.; Yamane, H.; Shimada, M.; Acta Crystallographica, Section E 57 (2001) i60–i61; doi:10.1107/S1600536801007346

data_9007900
_publ_section_title
;
 A powder diffraction study of Sr3Al10SiO20
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i60
_journal_page_last               i61
_journal_paper_doi               10.1107/S1600536801007346
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     Sr3Al10SiO20
_chemical_formula_sum            'Al10 O20 Si Sr3'
_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                 108.117
_cell_angle_gamma                90
_cell_length_a                   15.1416
_cell_length_b                   11.1843
_cell_length_c                   4.90256
_cell_formula_units_Z            2
_cell_volume                     789.079
_exptl_crystal_density_diffrn    3.707
_cod_original_formula_sum        'Sr3 Al10 Si O20'
_cod_database_code               9007900
_cod_duplicate_entry 2200374
Refinement of lithium tetrahydroxoborate with low-temperature CCD data
Fronczek, F. R.; Aubry, D. A.; Stanley, G. G.; Acta Crystallographica, Section E 57 (2001) i62–i63; doi:10.1107/S1600536801011163

data_9007901
_publ_section_title
;
 Refinement of lithium tetrahydroxoborate with low-temperature CCD data
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i62
_journal_page_last               i63
_journal_paper_doi               10.1107/S1600536801011163
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     LiB(OH)4
_chemical_formula_sum            'B H4 Li O4'
_space_group_IT_number           61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.9362
_cell_length_b                   8.5220
_cell_length_c                   9.1762
_cell_formula_units_Z            8
_cell_volume                     620.607
_exptl_crystal_density_diffrn    1.836
_cod_original_formula_sum        'Li B O4 H4'
_cod_database_code               9007901
_cod_duplicate_entry 2200380
Rerefinement of sodium thiosulfate pentahydrate
Prasad S M Rani A; Acta Crystallographica, Section E 57 (2001) i67–i69; doi:10.1107/S1600536801011175

data_9007902
_publ_section_title
;
 Rerefinement of sodium thiosulfate pentahydrate
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i67
_journal_page_last               i69
_journal_paper_doi               10.1107/S1600536801011175
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     Na2S2O3*5H2O
_chemical_formula_sum            'H10 Na2 O8 S2'
_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                 103.820
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.9470
_cell_length_b                   21.574
_cell_length_c                   7.5260
_cell_volume                     937.637
_database_code_amcsd             0010360
_exptl_crystal_density_diffrn    1.758
_cod_depositor_comments
;
Z value inserted and formula changed to be consistent with chemical composition
                               Miguel.
;
_cod_original_formula_sum        'Na S O4 H5'
_cod_database_code               9007902
_amcsd_formula_title             Na2S2O3*5H2O
Matlockite-type PbFI
Weil, M.; Kubel, F.; Acta Crystallographica, Section E 57 (2001) i80–i81; doi:10.1107/S1600536801013678

data_9007903
_publ_section_title
;
 Matlockite-type PbFI
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i80
_journal_page_last               i81
_journal_paper_doi               10.1107/S1600536801013678
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     PbFI
_chemical_formula_sum            'F I Pb'
_space_group_IT_number           129
_symmetry_space_group_name_Hall  '-P 4a 2a'
_symmetry_space_group_name_H-M   'P 4/n m m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.2374
_cell_length_b                   4.2374
_cell_length_c                   8.800
_cell_formula_units_Z            2
_cell_volume                     158.009
_exptl_crystal_density_diffrn    7.422
_cod_original_sg_symbol_H-M      'P 4/n m m'
_cod_original_formula_sum        'Pb I F'
_cod_database_code               9007903
_cod_duplicate_entry 2200401
PbGaBO4, an orthoborate with a new structure-type
Park, H.; Barbier, J.; Acta Crystallographica, Section E 57 (2001) i82–i84; doi:10.1107/S1600536801013940

data_9007904
_publ_section_title
;
 PbGaBO4, an orthoborate with a new structure-type
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i82
_journal_page_last               i84
_journal_paper_doi               10.1107/S1600536801013940
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     PbGaBO4
_chemical_formula_sum            'B Ga O4 Pb'
_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                   6.9944
_cell_length_b                   5.8925
_cell_length_c                   8.2495
_cell_formula_units_Z            4
_cell_volume                     339.999
_database_code_amcsd             0010362
_exptl_crystal_density_diffrn    6.871
_cod_original_formula_sum        'Pb Ga B O4'
_cod_database_code               9007904
_amcsd_formula_title             PbGaBO4
Hexagonal YbMnO3 revisited
Van Aken, B. B.; Meetsma, A.; Palstra, T. T. M.; Acta Crystallographica, Section E 57 (2001) i87–i89; doi:10.1107/S1600536801015094

data_9007905
_publ_section_title
;
 Hexagonal YbMnO3 revisited
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i87
_journal_page_last               i89
_journal_paper_doi               10.1107/S1600536801015094
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     YbMnO3
_chemical_formula_sum            'Mn O3 Yb'
_space_group_IT_number           185
_symmetry_space_group_name_Hall  'P 6c -2'
_symmetry_space_group_name_H-M   'P 63 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   6.0584
_cell_length_b                   6.0584
_cell_length_c                   11.3561
_cell_formula_units_Z            6
_cell_volume                     360.974
_database_code_amcsd             0010363
_exptl_crystal_density_diffrn    7.617
_cod_original_formula_sum        'Yb Mn O3'
_cod_database_code               9007905
_amcsd_formula_title             YbMnO3
Mn1-xFexS, x=0.05, an example of an anti-wurtzite structure
Eriksson, L.; Kalinowski, M. P.; Acta Crystallographica, Section E 57 (2001) i92–i93; doi:10.1107/S1600536801016051

data_9007906
_publ_section_title
;
 Mn1-xFexS, x=0.05, an example of an anti-wurtzite structure
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i92
_journal_page_last               i93
_journal_paper_doi               10.1107/S1600536801016051
_journal_volume                  57
_journal_year                    2001
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Fe0.05 Mn0.95 S'
_chemical_name_mineral           Rambergite
_space_group_IT_number           186
_symmetry_space_group_name_Hall  'P 6c -2c'
_symmetry_space_group_name_H-M   'P 63 m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   3.982
_cell_length_b                   3.982
_cell_length_c                   6.445
_cell_formula_units_Z            2
_cell_volume                     88.503
_database_code_amcsd             0010364
_exptl_crystal_density_diffrn    3.267
_cod_original_formula_sum        '(Mn.95 Fe.05) S'
_cod_database_code               9007906
Dipotassium carbonate sesquihydrate: rerefinement against new intensity data
Skakle, J. M. S.; Wilson, M.; Feldman, J.; Acta Crystallographica, Section E 57 (2001) i94–i97; doi:10.1107/S1600536801016312

data_9007907
_publ_section_title
;
 Dipotassium carbonate sesquihydrate: rerefinement against new intensity data
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i94
_journal_page_last               i97
_journal_paper_doi               10.1107/S1600536801016312
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     K2CO3*1.5H2O
_chemical_formula_sum            'C2 H6 K4 O9'
_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                 120.7690
_cell_angle_gamma                90
_cell_length_a                   11.8175
_cell_length_b                   13.7466
_cell_length_c                   7.1093
_cell_formula_units_Z            4
_cell_volume                     992.340
_database_code_amcsd             0010365
_exptl_crystal_density_diffrn    2.212
_cod_original_formula_sum        'K4 C2 O9 H6'
_cod_database_code               9007907
_amcsd_formula_title             K2CO3*1.5H2O
Schuetteite, Hg3(SO4)O2, a re-investigation Locality: synthetic
Weil, M.; Acta Crystallographica, Section E 57 (2001) i98–i100; doi:10.1107/S1600536801017561

data_9007908
_publ_section_title
;
 Schuetteite, Hg3(SO4)O2, a re-investigation
 Locality: synthetic
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i98
_journal_page_last               i100
_journal_paper_doi               10.1107/S1600536801017561
_journal_volume                  57
_journal_year                    2001
_chemical_formula_sum            'Hg5 O9 S2'
_chemical_name_mineral           Schuetteite
_space_group_IT_number           152
_symmetry_space_group_name_Hall  'P 31 2"'
_symmetry_space_group_name_H-M   'P 31 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   7.0429
_cell_length_b                   7.0429
_cell_length_c                   10.0166
_cell_formula_units_Z            2
_cell_volume                     430.283
_exptl_crystal_density_diffrn    9.348
_cod_original_formula_sum        'Hg5 S2 O9'
_cod_database_code               9007908
_cod_duplicate_entry 2200745
Hexagonal LuMnO3 revisited
Van Aken, B. B.; Meetsma, A.; Palstra, T. T. M.; Acta Crystallographica, Section E 57 (2001) i101–i103; doi:10.1107/S1600536801015896

data_9007909
_publ_section_title
;
 Hexagonal LuMnO3 revisited
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i101
_journal_page_last               i103
_journal_paper_doi               10.1107/S1600536801015896
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     LuMnO3
_chemical_formula_sum            'Lu Mn O3'
_space_group_IT_number           185
_symmetry_space_group_name_Hall  'P 6c -2'
_symmetry_space_group_name_H-M   'P 63 c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   6.0380
_cell_length_b                   6.0380
_cell_length_c                   11.3610
_cell_formula_units_Z            6
_cell_volume                     358.702
_database_code_amcsd             0010367
_exptl_crystal_density_diffrn    7.719
_cod_database_code               9007909
_amcsd_formula_title             LuMnO3
Copper(II) selenate pentahydrate, CuSeO4*5H2O
Kolitsch, U.; Acta Crystallographica, Section E 57 (2001) i104–i105; doi:10.1107/S1600536801018347

data_9007910
_publ_section_title
;
 Copper(II) selenate pentahydrate, CuSeO4*5H2O
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i104
_journal_page_last               i105
_journal_paper_doi               10.1107/S1600536801018347
_journal_volume                  57
_journal_year                    2001
_chemical_formula_structural     CuSeO4*5H2O
_chemical_formula_sum            'Cu H10 O9 Se'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                77.14
_cell_angle_beta                 82.20
_cell_angle_gamma                72.91
_cell_formula_units_Z            2
_cell_length_a                   6.0830
_cell_length_b                   6.2260
_cell_length_c                   10.867
_cell_volume                     382.430
_database_code_amcsd             0010368
_exptl_crystal_density_diffrn    2.576
_cod_original_formula_sum        'Cu Se O9 H10'
_cod_database_code               9007910
_amcsd_formula_title             CuSeO4*5H2O
Zinc(II) sulfate tetrahydrate Locality: synthetic
Blake, A. J.; Cooke, P. A.; Hubberstey, P.; Sampson, C. L.; Acta Crystallographica, Section E 57 (2001) i109–i111; doi:10.1107/S1600536801017998

data_9007911
_publ_section_title
;
 Zinc(II) sulfate tetrahydrate
 Locality: synthetic
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i109
_journal_page_last               i111
_journal_paper_doi               10.1107/S1600536801017998
_journal_volume                  57
_journal_year                    2001
_chemical_formula_sum            'H16 O16 S2 Zn2'
_chemical_name_mineral           Boyleite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.26
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.904
_cell_length_b                   13.519
_cell_length_c                   7.883
_cell_volume                     629.184
_exptl_crystal_density_diffrn    2.465
_cod_duplicate_entry             2200782
_cod_depositor_comments
;
  Z value inserted and formula changed to reflect dimeric structure
                               Miguel.
;
_cod_original_formula_sum        'Zn S O8 H8'
_cod_database_code               9007911
Redetermination of the mixed-valence manganese arsenate flinkite, MnII2MnIII(OH)4(AsO4) Locality: synthetic
Kolitsch, U.; Acta Crystallographica, Section E 57 (2001) i115–i118; doi:10.1107/S1600536801020050

data_9007912
_publ_section_title
;
 Redetermination of the mixed-valence manganese arsenate flinkite,
 MnII2MnIII(OH)4(AsO4)
 Locality: synthetic
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i115
_journal_page_last               i118
_journal_paper_doi               10.1107/S1600536801020050
_journal_volume                  57
_journal_year                    2001
_chemical_formula_sum            'As H4 Mn3 O8'
_chemical_name_mineral           Flinkite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.483
_cell_length_b                   13.030
_cell_length_c                   5.3390
_cell_volume                     659.705
_exptl_crystal_density_diffrn    3.743
_cod_duplicate_entry             2200588
_cod_original_formula_sum        'Mn3 As O8 H4'
_cod_database_code               9007912
Refinement of pyrobelonite, PbMnIIVO4(OH), a member of the descloizite group
Kolitsch, U.; Acta Crystallographica, Section E 57 (2001) i119–i121; doi:10.1107/S1600536801020037

data_9007913
_publ_section_title
;
 Refinement of pyrobelonite, PbMnIIVO4(OH), a member of the descloizite group
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i119
_journal_page_last               i121
_journal_paper_doi               10.1107/S1600536801020037
_journal_volume                  57
_journal_year                    2001
_chemical_compound_source        Synthetic
_chemical_formula_sum            'H Mn O5 Pb V'
_chemical_name_mineral           Pyrobelonite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.646
_cell_length_b                   6.1790
_cell_length_c                   9.507
_cell_volume                     449.155
_database_code_amcsd             0010371
_exptl_crystal_density_diffrn    5.828
_cod_original_formula_sum        'Pb Mn V O5 H'
_cod_database_code               9007913
Ytterbium cobalt gallium oxide, YbCoGaO4, as grown by the floating zone technique
Dabkowska, H. A.; Gaulin, B. D.; Dabkowski, A.; Luke, G. M.; Britten, J. F.; Acta Crystallographica, Section E 58 (2002) i1–i2; doi:10.1107/S1600536801020062

data_9007914
_publ_section_title
;
 Ytterbium cobalt gallium oxide, YbCoGaO4, as grown by the floating zone
 technique
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i1
_journal_page_last               i2
_journal_paper_doi               10.1107/S1600536801020062
_journal_volume                  58
_journal_year                    2002
_chemical_formula_structural     YbCoGaO4
_chemical_formula_sum            'Co0.5 Ga0.5 O2 Yb0.5'
_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                   3.41650
_cell_length_b                   3.41650
_cell_length_c                   25.1220
_cell_formula_units_Z            6
_cell_volume                     253.950
_exptl_crystal_density_diffrn    7.174
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Yb.5 (Co.5 Ga.5) O2'
_cod_database_code               9007914
_cod_duplicate_entry 2200813
Magnesium selenate hexahydrate, MgSeO4*6H2O
Kolitsch, U.; Acta Crystallographica, Section E 58 (2002) i3–i5; doi:10.1107/S1600536801020864

data_9007915
_publ_section_title
;
 Magnesium selenate hexahydrate, MgSeO4*6H2O
;
_journal_name_full               'Acta Crystallographica, Section E'
_journal_page_first              i3
_journal_page_last               i5
_journal_paper_doi               10.1107/S1600536801020864
_journal_volume                  58
_journal_year                    2002
_chemical_formula_structural     MgSeO4*6H2O
_chemical_formula_sum            'H12 Mg O10 Se'
_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                 98.410
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   10.2240
_cell_length_b                   7.3700
_cell_length_c                   24.866
_cell_volume                     1853.527
_database_code_amcsd             0010373
_exptl_crystal_density_diffrn    1.973
_cod_original_formula_sum        'Mg Se O10 H12'
_cod_database_code               9007915
_amcsd_formula_title             MgSeO4*6H2O