LMucko/crystallography-open-database huggingface dataset:
Crystal structure of tetraaquamanganese(II) selenate monohydrate, Mn(H~2~O)~4~SeO~4~ · H~2~O
Euler, H.; Meents, A.; Barbier, B.; Kirfel, A.; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 9–10; doi:

data_8100297
_publ_section_title
;
Crystal structure of tetraaquamanganese(II) selenate monohydrate, 
Mn(H~2~O)~4~SeO~4~ &#x00B7; H~2~O
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              9
_journal_page_last               10
_journal_volume                  218
_journal_year                    2003
_chemical_formula_moiety         '(Mn+2), (SeO4 2-), 5(H2O)'
_chemical_formula_structural     'MnSeO4 &#x00B7; 5H2 O'
_chemical_formula_sum            'H10 Mn O9 Se'
_chemical_formula_weight         287.98
_chemical_name_common            'manganese selenate pentahydrate'
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                81.45(2)
_cell_angle_beta                 109.431(16)
_cell_angle_gamma                104.37(3)
_cell_formula_units_Z            2
_cell_length_a                   6.471(3)
_cell_length_b                   10.898(3)
_cell_length_c                   6.263(4)
_cell_measurement_temperature    293(2)
_cell_volume                     402.5(3)
_diffrn_ambient_temperature      295(2)
_exptl_crystal_density_diffrn    2.376
_cod_database_code               8100297
Refinement of the crystal structure of gallium oxide hydroxide, GaO(OH)
Li, S.-J.; Zheng, C.; Lobring, K. C.; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 11–12; doi:

data_8100298
_publ_section_title
;
Refinement of the crystal structure of gallium oxide hydroxide, GaO(OH)
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              11
_journal_page_last               12
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     GaO(OH)
_chemical_formula_sum            'Ga H O2'
_chemical_formula_weight         102.73
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.7907(8)
_cell_length_b                   2.9732(2)
_cell_length_c                   4.5171(4)
_cell_measurement_temperature    293(2)
_cell_volume                     131.491(18)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    5.189
_cod_original_formula_sum        'H Ga O2'
_cod_database_code               8100298
Crystal structure of dilithium ethylenediammonium bis[sulfate], (C~2~N~2~H~10~)Li~2~(SO~4~)~2~
Held, Peter; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 13–14; doi:

data_8100299
_publ_section_title
;
Crystal structure of dilithium ethylenediammonium bis[sulfate], 
(C~2~N~2~H~10~)Li~2~(SO~4~)~2~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              13
_journal_page_last               14
_journal_volume                  218
_journal_year                    2003
_chemical_formula_moiety         '(C2 H10 N2 2+), 2(Li +), 2(S O4 2-)'
_chemical_formula_structural     '(C2 N2 H10) Li2 (SO4)2'
_chemical_formula_sum            'C2 H10 Li2 N2 O8 S2'
_chemical_formula_weight         268.12
_chemical_name_common
;
dilithium ethylenediammonium bis[sulfate]
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 99.599(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   18.590(1)
_cell_length_b                   4.9035(4)
_cell_length_c                   10.1666(4)
_cell_measurement_temperature    293(2)
_cell_volume                     913.8(1)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.949
_refine_diff_density_rms         0.087
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               8100299
Crystal structure of rubidium gallium catena-[monohydrogen-monoborate-bis(monophosphate)] RbGa[BP2O8(OH)], from a twinned crystal
Mi, Jin-Xiao; Borrmann, Horst; Mao, Shao-Yu; Huang, Ya-Xi; Zhang, Hui; Zhao, Jing-Tai; Kniep, Rüdiger; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 17–18; doi:10.1524/ncrs.2003.218.1.17

data_8100300
_publ_section_title
;
 Crystal structure of rubidium gallium
 catena-[monohydrogen-monoborate-bis(monophosphate)]
 RbGa[BP2O8(OH)], from a twinned crystal
;
_journal_coden_ASTM              ZKNSFT
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              17
_journal_page_last               18
_journal_paper_doi               10.1524/ncrs.2003.218.1.17
_journal_volume                  218
_journal_year                    2003
_chemical_formula_moiety         'RbGa[BP2 O8 (OH)]'
_chemical_formula_structural     'RbGa[BP2 O8 (OH)]'
_chemical_formula_sum            'B Ga H O9 P2 Rb'
_chemical_formula_weight         372.95
_chemical_name_common            'RbGa[BP2 O8 (OH)]'
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 102.527(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.3207(8)
_cell_length_b                   8.3686(7)
_cell_length_c                   9.5371(9)
_cell_measurement_temperature    295(2)
_cell_volume                     726.20(11)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    3.411
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'B1 Ga1 O9 H1 P2 Rb1'
_cod_database_code               8100300
Crystal structure of dicaesium hexachlorotungstate(IV), Cs~2~[WCl~6~]
Wang, Ping; Xu, Wei; Zheng, Yue-Qing; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 25–25; doi:

data_8100301
_publ_section_title
;
Crystal structure of dicaesium hexachlorotungstate(IV), Cs~2~[WCl~6~]
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              25
_journal_page_last               25
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'Cs2 [WCl6]'
_chemical_formula_sum            'Cl6 Cs2 W'
_chemical_formula_weight         662.37
_space_group_IT_number           225
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.245(1)
_cell_length_b                   10.245(1)
_cell_length_c                   10.245(1)
_cell_measurement_temperature    293(2)
_cell_volume                     1075.3(2)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    4.091
_cod_original_formula_sum        'Cl6 Cs2 W1'
_cod_database_code               8100301
Crystal structure of rubidium gallium catena-[monohydrogen-monoborate- bis(monophosphate)] RbGa[BP~2~O~8~(OH)], from a twinned crystal
Held, Peter; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 15–16; doi:

data_8100302
_publ_section_title
;
Crystal structure of rubidium gallium catena-[monohydrogen-monoborate-
bis(monophosphate)] RbGa[BP~2~O~8~(OH)], from a twinned crystal
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              15
_journal_page_last               16
_journal_volume                  218
_journal_year                    2003
_chemical_formula_moiety
;
(C2 H10 N2) K2 (HPO4)2 &#x00B7; 6(H2O)
;
_chemical_formula_structural     '(C2 H10 N2) K2 (HPO4)2 &#x00B7; 6(H2O)'
_chemical_formula_sum            'C2 H24 K2 N2 O14 P2'
_chemical_formula_weight         440.37
_chemical_name_common
;
dipotassium ethylenediammonium bis[monohydrogentetraoxophosphate(V)]
hexahydrate
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 102.86(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   11.803(1)
_cell_length_b                   10.6000(7)
_cell_length_c                   6.9658(7)
_cell_measurement_temperature    293(2)
_cell_volume                     849.6(1)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.721
_refine_diff_density_rms         0.072
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               8100302
Crystal structure of terbium sulfate octahydrate, Tb~2~(SO~4~)~3~ · 8H~2~O, and of dysprosium sulfate octahydrate, Dy~2~(SO~4~)~3~ · 8H~2~O
Wei, Dan-Yi; Zheng, Yue-Qing; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 23–24; doi:

data_8100303
_publ_section_title
;
Crystal structure of terbium sulfate octahydrate, 
Tb~2~(SO~4~)~3~ &#x00B7; 8H~2~O, and of dysprosium sulfate octahydrate, 
Dy~2~(SO~4~)~3~ &#x00B7; 8H~2~O
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              23
_journal_page_last               24
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'Tb2 (SO4)3 &#x00B7; 8H2 O'
_chemical_formula_sum            'H16 O20 S3 Tb2'
_chemical_formula_weight         750.15
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 102.16(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.493(3)
_cell_length_b                   6.7140(10)
_cell_length_c                   18.231(3)
_cell_measurement_temperature    293(2)
_cell_volume                     1614.5(5)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    3.086
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               8100303
Crystal structure of terbium sulfate octahydrate, Tb~2~(SO~4~)~3~ · 8H~2~O, and of dysprosium sulfate octahydrate, Dy~2~(SO~4~)~3~ · 8H~2~O
Wei, Dan-Yi; Zheng, Yue-Qing; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 23–24; doi:

data_8100304
_publ_section_title
;
Crystal structure of terbium sulfate octahydrate, 
Tb~2~(SO~4~)~3~ &#x00B7; 8H~2~O, and of dysprosium sulfate octahydrate, 
Dy~2~(SO~4~)~3~ &#x00B7; 8H~2~O
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              23
_journal_page_last               24
_journal_volume                  218
_journal_year                    2003
_chemical_formula_sum            'Dy2 H16 O20 S3'
_chemical_formula_weight         757.31
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 102.060(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.469(2)
_cell_length_b                   6.6950(10)
_cell_length_c                   18.202(3)
_cell_measurement_temperature    293(2)
_cell_volume                     1605.1(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    3.134
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_original_formula_sum        'H16 Dy2 O20 S3'
_cod_database_code               8100304
Crystal structure of terbium sulfate octahydrate, Tb~2~(SO~4~)~3~ · 8H~2~O, and of dysprosium sulfate octahydrate, Dy~2~(SO~4~)~3~ · 8H~2~O
Wei, Dan-Yi; Zheng, Yue-Qing; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 23–24; doi:

data_8100305
_publ_section_title
;
Crystal structure of terbium sulfate octahydrate, 
Tb~2~(SO~4~)~3~ &#x00B7; 8H~2~O, and of dysprosium sulfate octahydrate, 
Dy~2~(SO~4~)~3~ &#x00B7; 8H~2~O
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              23
_journal_page_last               24
_journal_volume                  218
_journal_year                    2003
_chemical_formula_sum            'Dy2 H16 O20 S3'
_chemical_formula_weight         757.31
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 102.060(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.469(2)
_cell_length_b                   6.6950(10)
_cell_length_c                   18.202(3)
_cell_measurement_temperature    293(2)
_cell_volume                     1605.1(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    3.134
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_original_formula_sum        'H16 Dy2 O20 S3'
_cod_database_code               8100305
_cod_duplicate_entry 8100304
Crystal structure of sodium ytterbium(III) selenide, NaYbSe~2~
Gray, Amy K.; Martin, Benjamin R.; Dorhout, Peter K.; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 19–19; doi:

data_8100306
_publ_section_title
;
Crystal structure of sodium ytterbium(III) selenide, NaYbSe~2~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              19
_journal_page_last               19
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     NaYbSe2
_chemical_formula_sum            'Na Se2 Yb'
_chemical_formula_weight         353.95
_space_group_IT_number           166
_symmetry_cell_setting           rhombohedral
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   4.0568(8)
_cell_length_b                   4.0568(8)
_cell_length_c                   20.772(6)
_cell_measurement_temperature    298(2)
_cell_volume                     296.06(12)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    5.956
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Rhombohedral' changed to 'rhombohedral'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'Na1 Yb1 Se2'
_cod_database_code               8100306
Crystal structure of potassium ytterbium(III) selenide, KYbSe~2~
Gray, Amy K.; Martin, Benjamin R.; Dorhout, Peter K.; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 20–20; doi:

data_8100307
_publ_section_title
;
Crystal structure of potassium ytterbium(III) selenide, KYbSe~2~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              20
_journal_page_last               20
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     KYbSe2
_chemical_formula_sum            'K Se2 Yb'
_chemical_formula_weight         370.06
_space_group_IT_number           166
_symmetry_cell_setting           rhombohedral
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   4.1110(18)
_cell_length_b                   4.1110(18)
_cell_length_c                   22.697(14)
_cell_measurement_temperature    293(2)
_cell_volume                     332.2(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    5.549
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Rhombohedral' changed to 'rhombohedral'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'K1 Yb1 Se2'
_cod_database_code               8100307
Crystal structure of tetraaluminium trinitride carbide oxide, Al~4~N~3~CO
Zhang, F.X.; Tanaka, T.; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 27–28; doi:

data_8100308
_publ_section_title
;
Crystal structure of tetraaluminium trinitride carbide oxide, Al~4~N~3~CO
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              27
_journal_page_last               28
_journal_volume                  218
_journal_year                    2003
_chemical_formula_moiety         Al4N3CO
_chemical_formula_structural     'Al4 N3 CO'
_chemical_formula_sum            'C Al4 N3 O'
_chemical_formula_weight         177.96
_space_group_IT_number           36
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   5.7431(5)
_cell_length_b                   8.5283(10)
_cell_length_c                   9.0943(10)
_cell_measurement_temperature    293(2)
_cell_volume                     445.43(8)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    2.654
_cod_database_code               8100308
Crystal structure of dysprosium borosilicide, Dy~0.7~B~12.33~Si~3~
Zhang, F. X.; Tanaka, T.; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 26–26; doi:

data_8100309
_publ_section_title
;
Crystal structure of dysprosium borosilicide, Dy~0.7~B~12.33~Si~3~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              26
_journal_page_last               26
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'Dy0.7 B12.33 Si3'
_chemical_formula_sum            'B12.33 Dy0.7 Si3'
_chemical_formula_weight         330.80
_space_group_IT_number           166
_symmetry_cell_setting           rhombohedral
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            9
_cell_length_a                   10.0782(3)
_cell_length_b                   10.0782(3)
_cell_length_c                   16.4651(4)
_cell_measurement_temperature    293(2)
_cell_volume                     1448.31(7)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    3.413
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_original_formula_sum        'B12.33 Dy0.70 Si3'
_cod_database_code               8100309
Crystal structure of ammonium tetrachloromercurate(II) monohydrate, (NH~4~)~2~HgCl~4~ · H~2~O
Loukil, Mohamed; Kabadou, Ahlem; Svoboda, Ingrid; Ehrenberg, Helmut; Ben Salah, Abd Elhamid; Fuess, Hartmut; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 29–30; doi:

data_8100310
_publ_section_title
;
Crystal structure of ammonium tetrachloromercurate(II) monohydrate, 
(NH~4~)~2~HgCl~4~ &#x00B7; H~2~O
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              29
_journal_page_last               30
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     '(NH4)2 HgCl4 . H2 O'
_chemical_formula_sum            'Cl4 H10 Hg N2 O'
_chemical_formula_weight         396.49
_space_group_IT_number           55
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2 2ab'
_symmetry_space_group_name_H-M   'P b a m'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.473(3)
_cell_length_b                   11.929(3)
_cell_length_c                   9.197(3)
_cell_measurement_temperature    299(2)
_cell_volume                     929.6(5)
_diffrn_ambient_temperature      299(2)
_exptl_crystal_density_diffrn    2.833
_cod_original_formula_sum        'H10 Cl4 Hg N2 O'
_cod_database_code               8100310
Crystal structure of thallium arsenic diselenide, TlAsSe~2~
Wacker, K.; Kutoglu, A.; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 7–8; doi:10.1524/ncrs.2003.218.1.7

data_8100311
_publ_section_title
;
Crystal structure of thallium arsenic diselenide, TlAsSe~2~
;
_journal_coden_ASTM              ZKNSFT
_journal_issue                   1
_journal_name_full
;
 Zeitschrift f\"ur Kristallographie - New Crystal Structures
;
_journal_page_first              7
_journal_page_last               8
_journal_paper_doi               10.1524/ncrs.2003.218.1.7
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     TlAsSe2
_chemical_formula_sum            'As Se2 Tl'
_chemical_formula_weight         437.21
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 102.85(4)
_cell_angle_gamma                90.000
_cell_formula_units_Z            16
_cell_length_a                   12.141(3)
_cell_length_b                   23.633(6)
_cell_length_c                   6.243(1)
_cell_volume                     1746.4
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    6.65
_cod_depositor_comments
;
 Updating space group information.

 Antanas Vaitkus,
 2018-07-15
;
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_original_formula_sum        'Tl As Se2'
_cod_database_code               8100311