LMucko/crystallography-open-database huggingface dataset:
Structural change in a series of protonated layered perovskite compounds, H Ln Ti O4 (Ln= La, Nd and Y)
Nishimoto, S.; Hoshikawa, A.; Harjo, S.; Matsuda, M.; Kamiyama, T.; Ishigaki, T.; Miyake, M.; Journal of Solid State Chemistry 179 (2006) 1892–1897; doi:

data_1528763
_publ_section_title
;
 Structural change in a series of protonated layered perovskite compounds,
 H Ln Ti O4 (Ln= La, Nd and Y)
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1892
_journal_page_last               1897
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'D O4 Ti Y'
_chemical_name_systematic        'D Y (Ti O4)'
_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                 90.441
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.46
_cell_length_b                   5.292
_cell_length_c                   5.3628
_cell_volume                     325.224
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Nishimoto_JSSCBI_2006_1168.cif
_cod_data_source_block           D1O4Ti1Y1
_cod_original_cell_volume        325.2245
_cod_original_formula_sum        'D1 O4 Ti1 Y1'
_cod_database_code               1528763
Old friends in a new light: "Sb Sn" revisited
Noren, L.; Schmid, S.; Withers, R.L.; Brink, F.J.; Ting, V.; Journal of Solid State Chemistry 179 (2006) 404–412; doi:

data_1528764
_publ_section_title
;
 Old friends in a new light: "Sb Sn" revisited
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              404
_journal_page_last               412
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Sb0.49 Sn0.51'
_chemical_name_systematic        '(Sn0.51 Sb0.49)'
_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_formula_units_Z            3
_cell_length_a                   4.3251
_cell_length_b                   4.3251
_cell_length_c                   5.3376
_cell_volume                     86.471
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Noren_JSSCBI_2006_913.cif
_cod_data_source_block           Sb0.49Sn0.51
_cod_original_cell_volume        86.4707
_cod_database_code               1528764
Ueber eine ternaere Verbindung im System Aluminium-Silicium- Natrium
Nowotny, H.; Scheil, E.; Metallforschung 3 (1947) 76–80; doi:

data_7221497
_publ_section_title
;
 Ueber eine ternaere Verbindung im System Aluminium-Silicium- Natrium
;
_journal_name_full               Metallforschung
_journal_page_first              76
_journal_page_last               80
_journal_volume                  3
_journal_year                    1947
_chemical_formula_sum            'Al Na Si4'
_chemical_name_systematic        'Na Al Si4'
_space_group_IT_number           129
_symmetry_space_group_name_Hall  'P 4ab 2ab -1ab'
_symmetry_space_group_name_H-M   'P 4/n m m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.13
_cell_length_b                   4.13
_cell_length_c                   7.4
_cell_volume                     126.221
_citation_journal_id_ASTM        MEFGAZ
_cod_data_source_file            Nowotny_MEFGAZ_1947_310.cif
_cod_data_source_block           Al1Na1Si4
_cod_original_cell_volume        126.2211
_cod_original_sg_symbol_Hall     '-P 4a 2a (x-1/4,y+1/4,z)'
_cod_original_formula_sum        'Al1 Na1 Si4'
_cod_database_code               7221497
The crystal structure of (N H4)2 (Cu (H2 O)6) (Cu S O3)4
Nyberg, B.; Acta Crystallographica B (24,1968-38,1982) 34 (1978) 1418–1421; doi:

data_2106574
_publ_section_title
;
 The crystal structure of (N H4)2 (Cu (H2 O)6) (Cu S O3)4
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1418
_journal_page_last               1421
_journal_volume                  34
_journal_year                    1978
_chemical_formula_sum            'Cu5 H20 N2 O18 S4'
_chemical_name_systematic        '(N H4)2 (Cu (H2 O)6) (Cu S O3)4'
_space_group_IT_number           86
_symmetry_space_group_name_Hall  '-P 4bc'
_symmetry_space_group_name_H-M   'P 42/n :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   14.876
_cell_length_b                   14.876
_cell_length_c                   17.218
_cell_volume                     3810.264
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Nyberg_ACBCAR_1978_671.cif
_cod_data_source_block           H20Cu5N2O18S4
_cod_original_formula_sum        'H20 Cu5 N2 O18 S4'
_cod_database_code               2106574
The Crystal Structure of Potassium Fluorosulfate
O'Sullivan, K.; Thompson, R.C.; Trotter, J.; Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971) 1967 (1967) 2024–2027; doi:

data_1528765
_publ_section_title
;
 The Crystal Structure of Potassium Fluorosulfate
;
_journal_name_full
;
Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971)
;
_journal_page_first              2024
_journal_page_last               2027
_journal_volume                  1967
_journal_year                    1967
_chemical_formula_sum            'F K O3 S'
_chemical_name_systematic        'K S O3 F'
_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                   8.62
_cell_length_b                   5.84
_cell_length_c                   7.35
_cell_volume                     370.005
_citation_journal_id_ASTM        JCSIAP
_cod_data_source_file            OSullivan_JCSIAP_1967_326.cif
_cod_data_source_block           F1K1O3S1
_cod_original_cell_volume        370.0049
_cod_original_formula_sum        'F1 K1 O3 S1'
_cod_database_code               1528765
New open-framework in the uranyl vanadates A3 (U O2)7 (V O4)5 O (A = Li, Ag) with intergrowth structure between A (U O2)4 (V O4)3 and A2 (U O2)3 (V O4)2 O
Obbade, S.; Renard, C.; Abraham, F.; Journal of Solid State Chemistry 182 (2009) 413–420; doi:

data_1528766
_publ_section_title
;
 New open-framework in the uranyl vanadates A3 (U O2)7 (V O4)5 O (A = Li,
 Ag) with intergrowth structure between A (U O2)4 (V O4)3 and A2 (U O2)3
 (V O4)2 O
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              413
_journal_page_last               420
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'Li3 O35 U7 V5'
_chemical_name_systematic        'Li3 (U O2)7 (V O4)5 O'
_space_group_IT_number           115
_symmetry_space_group_name_Hall  'P -4 -2'
_symmetry_space_group_name_H-M   'P -4 m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   7.2794
_cell_length_b                   7.2794
_cell_length_c                   14.514
_cell_volume                     769.092
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Obbade_JSSCBI_2009_1706.cif
_cod_data_source_block           Li3O35U7V5
_cod_database_code               1528766
Real structure of Sr Si2 O2 N2
Oeckler, O.; Stadler, F.; Schnick, W.; Rosenthal, T.; Solid State Sciences 9 (2007) 205–212; doi:

data_1528767
_publ_section_title
;
 Real structure of Sr Si2 O2 N2
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              205
_journal_page_last               212
_journal_volume                  9
_journal_year                    2007
_chemical_formula_sum            'N2 O2 Si2 Sr1.02'
_chemical_name_systematic        'Sr1.02 Si2 O2 N2'
_space_group_IT_number           1
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                88.7669
_cell_angle_beta                 84.7333
_cell_angle_gamma                75.9047
_cell_formula_units_Z            4
_cell_length_a                   7.08021
_cell_length_b                   7.23058
_cell_length_c                   7.25535
_cell_volume                     358.727
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Oeckler_SSSCFJ_2007_1210.cif
_cod_data_source_block           N2O2Si2Sr1.02
_cod_original_cell_volume        358.7265
_cod_database_code               1528767
Asymmetric cationic coordination environments in new oxide materials: synthesis and characterization of Pb4 Te6 M10 O41 (M = Nb(5+) or Ta(5+))
Ok, K.M.; Halasyamani, P.S.; Inorganic Chemistry 43 (2004) 4248–4253; doi:

data_4343885
_publ_section_title
;
 Asymmetric cationic coordination environments in new oxide materials:
 synthesis and characterization of Pb4 Te6 M10 O41 (M = Nb(5+) or Ta(5+))
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              4248
_journal_page_last               4253
_journal_volume                  43
_journal_year                    2004
_chemical_formula_sum            'Nb10 O41 Pb4.67 Te6'
_chemical_name_systematic        'Pb4 Te6 Nb10 O41'
_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                 99.63
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   23.412
_cell_length_b                   20.114
_cell_length_c                   7.5008
_cell_volume                     3482.420
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Ok_INOCAJ_2004_454.cif
_cod_data_source_block           Nb10O41Pb4.67Te6
_cod_original_cell_volume        3482.421
_cod_database_code               4343885
Mixed-metal tellurites: synthesis, structure, and characterization of Na1.4 Nb3 Te4.9 O18 and Na Nb3 Te4 O16
Ok, K.M.; Halasyamani, P.S.; Inorganic Chemistry 44 (2005) 3919–3925; doi:

data_4343886
_publ_section_title
;
 Mixed-metal tellurites: synthesis, structure, and characterization of
 Na1.4 Nb3 Te4.9 O18 and Na Nb3 Te4 O16
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3919
_journal_page_last               3925
_journal_volume                  44
_journal_year                    2005
_chemical_formula_sum            'Na1.4 Nb3 O18 Te4.9'
_chemical_name_systematic        'Na1.40 Nb3 Te4.90 O18'
_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                 95.636
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   32.377
_cell_length_b                   7.4541
_cell_length_c                   6.5649
_cell_volume                     1576.723
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Ok_INOCAJ_2005_622.cif
_cod_data_source_block           Na1.4Nb3O18Te4.9
_cod_database_code               4343886
Mixed-metal tellurites: synthesis, structure, and characterization of Na1.4 Nb3 Te4.9 O18 and Na Nb3 Te4 O16
Ok, K.M.; Halasyamani, P.S.; Inorganic Chemistry 44 (2005) 3919–3925; doi:

data_4343887
_publ_section_title
;
 Mixed-metal tellurites: synthesis, structure, and characterization of
 Na1.4 Nb3 Te4.9 O18 and Na Nb3 Te4 O16
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3919
_journal_page_last               3925
_journal_volume                  44
_journal_year                    2005
_chemical_formula_sum            'Na Nb3 O16 Te4'
_chemical_name_systematic        'Na Nb3 Te4 O16'
_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                 102.98
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.6126
_cell_length_b                   7.4738
_cell_length_c                   14.034
_cell_volume                     675.856
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Ok_INOCAJ_2005_623.cif
_cod_data_source_block           Na1Nb3O16Te4
_cod_original_cell_volume        675.8559
_cod_original_formula_sum        'Na1 Nb3 O16 Te4'
_cod_database_code               4343887
Disodium ditungstate
Okada, K.; Morikawa, H.; Marumo, F.; Iwai, S.I.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 1200–1201; doi:

data_2106575
_publ_section_title
;
 Disodium ditungstate
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1200
_journal_page_last               1201
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Na2 O7 W2'
_chemical_name_systematic        'Na2 (W2 O7)'
_space_group_IT_number           64
_symmetry_space_group_name_Hall  '-C 2ac 2'
_symmetry_space_group_name_H-M   'C m c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.216
_cell_length_b                   11.899
_cell_length_c                   14.716
_cell_volume                     1263.563
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Okada_ACBCAR_1975_1967.cif
_cod_data_source_block           Na2O7W2
_cod_database_code               2106575
Crystal Structure of Triaminoguanidium Chloride, (NH~2~.NH)~3~C.Cl
Okaya, Y.; Pepinsky, R.; Acta Crystallographica (1,1948-23,1967) 10 (1957) 681–684; doi:10.1107/S0365110X57002364

data_2310643
_publ_section_title
;
 Crystal Structure of Triaminoguanidium Chloride, (NH~2~.NH)~3~C.Cl
;
_journal_issue                   11
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              681
_journal_page_last               684
_journal_paper_doi               10.1107/S0365110X57002364
_journal_volume                  10
_journal_year                    1957
_chemical_formula_sum            'C H9 Cl N6'
_chemical_name_systematic        '(N H2 N H)3 C Cl'
_space_group_IT_number           176
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   7.528
_cell_length_b                   7.528
_cell_length_c                   6.253
_cell_volume                     306.887
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Okaya_ACCRA9_1957_248.cif
_cod_data_source_block           C1H9Cl1N6
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2016-12-28
;
_cod_original_cell_volume        306.8868
_cod_original_formula_sum        'C1 H9 Cl1 N6'
_cod_database_code               2310643
Refinement of the crystal structure of tris(thiourea) copper(I) chloride
Okaya, Y.; Knobler, C.B.; Acta Crystallographica (1,1948-23,1967) 17 (1964) 928–930; doi:

data_2310644
_publ_section_title
;
 Refinement of the crystal structure of tris(thiourea) copper(I) chloride
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              928
_journal_page_last               930
_journal_volume                  17
_journal_year                    1964
_chemical_formula_sum            'C3 H12 Cl Cu N6 S3'
_chemical_name_systematic        'Cu ((N H2)2 C S)3 Cl'
_space_group_IT_number           92
_symmetry_space_group_name_Hall  'P 4abw 2nw'
_symmetry_space_group_name_H-M   'P 41 21 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   13.41
_cell_length_b                   13.41
_cell_length_c                   13.79
_cell_volume                     2479.829
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Okaya_ACCRA9_1964_158.cif
_cod_data_source_block           C3H12Cl1Cu1N6S3
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2017-08-09
;
_cod_original_formula_sum        'C3 H12 Cl1 Cu1 N6 S3'
_cod_database_code               2310644
The crystal structure of germanium selenide = Ge Se
Okazaki, A.; Journal of the Physical Society of Japan 13 (1958) 1151–1155; doi:

data_1528768
_publ_section_title
;
 The crystal structure of germanium selenide = Ge Se
;
_journal_name_full               'Journal of the Physical Society of Japan'
_journal_page_first              1151
_journal_page_last               1155
_journal_volume                  13
_journal_year                    1958
_chemical_formula_sum            'Ge Se'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2n 2ac'
_symmetry_space_group_name_H-M   'P c m n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.38
_cell_length_b                   3.82
_cell_length_c                   10.79
_cell_volume                     180.534
_citation_journal_id_ASTM        JUPSAU
_cod_data_source_file            Okazaki_JUPSAU_1958_411.cif
_cod_data_source_block           Ge1Se1
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,y,-x)'
_cod_original_formula_sum        'Ge1 Se1'
_cod_database_code               1528768
The reciprocal Cu In Se2 + 2Cd Se = Cu In Se2 + 2 Cd S system. Part I. The quasi-binary Cu In Se2 - Cd Se system: Phase diagram and crystal structure of solid solutions
Olekseyuk, I.D.; Parasyuk, O.V.; Piskach, L.V.; Dzham, O.A.; Journal of Solid State Chemistry 179 (2006) 315–322; doi:

data_1528769
_publ_section_title
;
 The reciprocal Cu In Se2 + 2Cd Se = Cu In Se2 + 2 Cd S system. Part I.
 The quasi-binary Cu In Se2 - Cd Se system: Phase diagram and crystal
 structure of solid solutions
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              315
_journal_page_last               322
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Cd0.06 Cu0.97 In0.97 Se2'
_chemical_name_systematic        'Cu0.97 Cd0.06 In0.97 Se2'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.7931
_cell_length_b                   5.7931
_cell_length_c                   11.16383
_cell_volume                     374.658
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Olekseyuk_JSSCBI_2006_1116.cif
_cod_data_source_block           Cd0.06Cu0.97In0.97Se2
_cod_original_cell_volume        374.6582
_cod_database_code               1528769
The reciprocal Cu In Se2 + 2Cd Se = Cu In Se2 + 2 Cd S system. Part I. The quasi-binary Cu In Se2 - Cd Se system: Phase diagram and crystal structure of solid solutions
Olekseyuk, I.D.; Dzham, O.A.; Parasyuk, O.V.; Piskach, L.V.; Journal of Solid State Chemistry 179 (2006) 315–322; doi:

data_1528770
_publ_section_title
;
 The reciprocal Cu In Se2 + 2Cd Se = Cu In Se2 + 2 Cd S system. Part I.
 The quasi-binary Cu In Se2 - Cd Se system: Phase diagram and crystal
 structure of solid solutions
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              315
_journal_page_last               322
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Cd Cu1.5 In1.5 Se4'
_chemical_name_systematic        'Cu1.5 Cd In1.5 Se4'
_space_group_IT_number           216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   5.8678
_cell_length_b                   5.8678
_cell_length_c                   5.8678
_cell_volume                     202.035
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Olekseyuk_JSSCBI_2006_1117.cif
_cod_data_source_block           Cd1Cu1.5In1.5Se4
_cod_original_cell_volume        202.0347
_cod_original_formula_sum        'Cd1 Cu1.5 In1.5 Se4'
_cod_database_code               1528770
The reciprocal Cu In Se2 + 2Cd Se = Cu In Se2 + 2 Cd S system. Part I. The quasi-binary Cu In Se2 - Cd Se system: Phase diagram and crystal structure of solid solutions
Olekseyuk, I.D.; Dzham, O.A.; Parasyuk, O.V.; Piskach, L.V.; Journal of Solid State Chemistry 179 (2006) 315–322; doi:

data_1528771
_publ_section_title
;
 The reciprocal Cu In Se2 + 2Cd Se = Cu In Se2 + 2 Cd S system. Part I.
 The quasi-binary Cu In Se2 - Cd Se system: Phase diagram and crystal
 structure of solid solutions
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              315
_journal_page_last               322
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Cd2.15 Cu0.93 In0.93 Se4'
_chemical_name_systematic        'Cu0.93 Cd2.15 In0.93 Se4'
_space_group_IT_number           216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   5.9598
_cell_length_b                   5.9598
_cell_length_c                   5.9598
_cell_volume                     211.687
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Olekseyuk_JSSCBI_2006_1118.cif
_cod_data_source_block           Cd2.15Cu0.93In0.93Se4
_cod_original_cell_volume        211.6874
_cod_database_code               1528771
The reciprocal Cu In Se2 + 2Cd Se = Cu In Se2 + 2 Cd S system. Part I. The quasi-binary Cu In Se2 - Cd Se system: Phase diagram and crystal structure of solid solutions
Olekseyuk, I.D.; Parasyuk, O.V.; Dzham, O.A.; Piskach, L.V.; Journal of Solid State Chemistry 179 (2006) 315–322; doi:

data_1528772
_publ_section_title
;
 The reciprocal Cu In Se2 + 2Cd Se = Cu In Se2 + 2 Cd S system. Part I.
 The quasi-binary Cu In Se2 - Cd Se system: Phase diagram and crystal
 structure of solid solutions
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              315
_journal_page_last               322
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Cd0.82 Cu0.09 In0.09 Se'
_chemical_name_systematic        'Cu0.09 Cd0.82 In0.09 Se'
_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_formula_units_Z            2
_cell_length_a                   4.2613
_cell_length_b                   4.2613
_cell_length_c                   69.59
_cell_volume                     1094.364
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Olekseyuk_JSSCBI_2006_1119.cif
_cod_data_source_block           Cd0.82Cu0.09In0.09Se1
_cod_original_formula_sum        'Cd0.82 Cu0.09 In0.09 Se1'
_cod_database_code               1528772