LMucko/crystallography-open-database huggingface dataset:
The crystal structure of cernyite, Cu2 Cd Sn S4, a cadmium analogue of Stannite
Szymanski, J.T.; Canadian Mineralogist 16 (1978) 147–151; doi:

data_1530856
_publ_section_title
;
 The crystal structure of cernyite, Cu2 Cd Sn S4, a cadmium analogue of
 Stannite
;
_journal_name_full               'Canadian Mineralogist'
_journal_page_first              147
_journal_page_last               151
_journal_volume                  16
_journal_year                    1978
_chemical_formula_sum            'Cd0.37 Cu2 Fe0.29 S4 Sn Zn0.33'
_chemical_name_systematic        'Cu2 (Cd0.37 Zn0.33 Fe0.29) Sn S4'
_space_group_IT_number           121
_symmetry_space_group_name_Hall  'I -4 2'
_symmetry_space_group_name_H-M   'I -4 2 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.487
_cell_length_b                   5.487
_cell_length_c                   10.848
_cell_volume                     326.603
_citation_journal_id_ASTM        CAMIA6
_cod_data_source_file            Szymanski_CAMIA6_1978_362.cif
_cod_data_source_block           Cd0.37Cu2Fe0.29S4Sn1Zn0.33
_cod_original_cell_volume        326.6026
_cod_original_formula_sum        'Cd0.37 Cu2 Fe0.29 S4 Sn1 Zn0.33'
_cod_database_code               1530856
Crystal structure of manganese sulfatouranylate Mn U O2 (S O4)2 (H2 O)5
Tabachenko, V.V.; Serezhkin, V.I.; Serezhkina, L.B.; Kovba, L.M.; Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 5 (1979) 1563–1568; doi:

data_1530857
_publ_section_title
;
 Crystal structure of manganese sulfatouranylate Mn U O2 (S O4)2 (H2 O)5
;
_journal_name_full
;
Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))
;
_journal_page_first              1563
_journal_page_last               1568
_journal_volume                  5
_journal_year                    1979
_chemical_formula_sum            'H10 Mn O15 S2 U'
_chemical_name_systematic        'Mn U O2 (S O4)2 (H2 O)5'
_space_group_IT_number           4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.79
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.506
_cell_length_b                   11.368
_cell_length_c                   8.338
_cell_volume                     616.622
_citation_journal_id_ASTM        KOKHDC
_cod_data_source_file            Tabachenko_KOKHDC_1979_545.cif
_cod_data_source_block           H10Mn1O15S2U1
_cod_original_cell_volume        616.6216
_cod_original_formula_sum        'H10 Mn1 O15 S2 U1'
_cod_database_code               1530857
Crystal structures of Mg (U O2)6 (Mo O4)7 (H2 O)18 and Sr (U O2)6 (Mo O4)7 (H2 O)15
Tabachenko, V.V.; Kovba, L.M.; Serezhkin, V.N.; Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 10 (1984) 558–562; doi:

data_1530858
_publ_section_title
;
 Crystal structures of Mg (U O2)6 (Mo O4)7 (H2 O)18 and Sr (U O2)6 (Mo
 O4)7 (H2 O)15
;
_journal_name_full
;
Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))
;
_journal_page_first              558
_journal_page_last               562
_journal_volume                  10
_journal_year                    1984
_chemical_formula_sum            'H28 Mg Mo7 O54 U6'
_chemical_name_systematic        'Mg (U O2)6 (Mo O4)7 (H2 O)14'
_space_group_IT_number           20
_symmetry_space_group_name_Hall  'C 2c 2'
_symmetry_space_group_name_H-M   'C 2 2 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.313
_cell_length_b                   20.163
_cell_length_c                   23.877
_cell_volume                     5446.440
_citation_journal_id_ASTM        KOKHDC
_cod_data_source_file            Tabachenko_KOKHDC_1984_1063.cif
_cod_data_source_block           H28Mg1Mo7O54U6
_cod_original_cell_volume        5446.44
_cod_original_formula_sum        'H28 Mg1 Mo7 O54 U6'
_cod_database_code               1530858
Crystal structures of Mg (U O2)6 (Mo O4)7 (H2 O)18 and Sr (U O2)6 (Mo O4)7 (H2 O)15
Tabachenko, V.V.; Kovba, L.M.; Serezhkin, V.N.; Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 10 (1984) 558–562; doi:

data_1530859
_publ_section_title
;
 Crystal structures of Mg (U O2)6 (Mo O4)7 (H2 O)18 and Sr (U O2)6 (Mo
 O4)7 (H2 O)15
;
_journal_name_full
;
Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))
;
_journal_page_first              558
_journal_page_last               562
_journal_volume                  10
_journal_year                    1984
_chemical_formula_sum            'H38 Mo7 O59 Sr U6'
_chemical_name_systematic        'Sr (U O2)6 (Mo O4)7 (H2 O)19'
_space_group_IT_number           20
_symmetry_space_group_name_Hall  'C 2c 2'
_symmetry_space_group_name_H-M   'C 2 2 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.166
_cell_length_b                   20.281
_cell_length_c                   24.061
_cell_volume                     5448.797
_citation_journal_id_ASTM        KOKHDC
_cod_data_source_file            Tabachenko_KOKHDC_1984_1064.cif
_cod_data_source_block           H38Mo7O59Sr1U6
_cod_original_cell_volume        5448.798
_cod_original_formula_sum        'H38 Mo7 O59 Sr1 U6'
_cod_database_code               1530859
Crystal Structure of Barium Uranyl Molybdate Ba (U O2)3 (Mo O4)4 (H2 O)4
Tabachenko, V.V.; Balashov, V.L.; Kovba, L.M.; Serezhkin, V.N.; Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 10 (1984) 854–857; doi:

data_1530860
_publ_section_title
;
 Crystal Structure of Barium Uranyl Molybdate Ba (U O2)3 (Mo O4)4 (H2 O)4
;
_journal_name_full
;
Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))
;
_journal_page_first              854
_journal_page_last               857
_journal_volume                  10
_journal_year                    1984
_chemical_formula_sum            'Ba H8 Mo4 O26 U3'
_chemical_name_systematic        'Ba (U O2)3 (Mo O4)4 (H2 O)4'
_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_formula_units_Z            8
_cell_length_a                   17.797
_cell_length_b                   11.975
_cell_length_c                   23.33
_cell_volume                     4972.068
_citation_journal_id_ASTM        KOKHDC
_cod_data_source_file            Tabachenko_KOKHDC_1984_1168.cif
_cod_data_source_block           H8Ba1Mo4O26U3
_cod_original_formula_sum        'H8 Ba1 Mo4 O26 U3'
_cod_database_code               1530860
Metal clusters with exposed and low-coordinate nitride nitrogen atoms
Tachikawa, M.; Stein, J.; Muetterties, E.L.; Beno, M.A.; Gebert, E.; Teller, R.G.; Williams, J.M.; Journal of the American Chemical Society 102 (1980) 6648–6649; doi:

data_4124468
_publ_section_title
;
 Metal clusters with exposed and low-coordinate nitride nitrogen atoms
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              6648
_journal_page_last               6649
_journal_volume                  102
_journal_year                    1980
_chemical_formula_sum            'C14 H Fe5 N O14'
_chemical_name_systematic        'H Fe5 N (C O)14'
_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                 95.42
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.473
_cell_length_b                   15.056
_cell_length_c                   16.048
_cell_volume                     2038.082
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Tachikawa_JACSAT_1980_723.cif
_cod_data_source_block           C14H1Fe5N1O14
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'C14 H1 Fe5 N1 O14'
_cod_database_code               4124468
Potassium lead hexanitroniccolate(II)
Takagi, S.; Joesten, M.D.; Lenhert, P.G.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 1968–1970; doi:

data_2106729
_publ_section_title
;
 Potassium lead hexanitroniccolate(II)
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1968
_journal_page_last               1970
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'K2 N6 Ni O12 Pb'
_chemical_name_systematic        'K2 Pb Ni (N O2)6'
_space_group_IT_number           202
_symmetry_space_group_name_Hall  '-F 2 2 3'
_symmetry_space_group_name_H-M   'F m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.5775
_cell_length_b                   10.5775
_cell_length_c                   10.5775
_cell_volume                     1183.448
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Takagi_ACBCAR_1975_55.cif
_cod_data_source_block           K2N6Ni1O12Pb1
_cod_original_formula_sum        'K2 N6 Ni1 O12 Pb1'
_cod_database_code               2106729
Potassium barium hexanitroniccolate(II)
Takagi, S.; Lehnert, P.G.; Joesten, M.D.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 1970–1972; doi:

data_2106730
_publ_section_title
;
 Potassium barium hexanitroniccolate(II)
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1970
_journal_page_last               1972
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Ba K2 N6 Ni O12'
_chemical_name_systematic        'K2 Ba (Ni (N O2)6)'
_space_group_IT_number           202
_symmetry_space_group_name_Hall  '-F 2 2 3'
_symmetry_space_group_name_H-M   'F m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.78
_cell_length_b                   10.78
_cell_length_c                   10.78
_cell_volume                     1252.727
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Takagi_ACBCAR_1975_628.cif
_cod_data_source_block           Ba1K2N6Ni1O12
_cod_original_cell_volume        1252.726
_cod_original_formula_sum        'Ba1 K2 N6 Ni1 O12'
_cod_database_code               2106730
Hydrothermal Synthesis and Structure Determination of a New Manganese (III) Oxide, Ba Mn2 O3 (O H)2
Tamada, O.; Yamamoto, N.; Oka, Y.; Journal of Solid State Chemistry 74 (1988) 401–408; doi:

data_1530861
_publ_section_title
;
 Hydrothermal Synthesis and Structure Determination of a New Manganese
 (III) Oxide, Ba Mn2 O3 (O H)2
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              401
_journal_page_last               408
_journal_volume                  74
_journal_year                    1988
_chemical_formula_sum            'Ba H2 Mn2 O5'
_chemical_name_systematic        'Ba Mn2 O3 (O H)2'
_space_group_IT_number           38
_symmetry_space_group_name_Hall  'C -2 -2'
_symmetry_space_group_name_H-M   'C m 2 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   11.585
_cell_length_b                   4.12
_cell_length_c                   4.39
_cell_volume                     209.536
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Tamada_JSSCBI_1988_1621.cif
_cod_data_source_block           H2Ba1Mn2O5
_cod_original_cell_volume        209.5356
_cod_original_sg_symbol_Hall     'A 2 -2 (y,z,x)'
_cod_original_formula_sum        'H2 Ba1 Mn2 O5'
_cod_database_code               1530861
The Crystal Structure of Tripotassium Aluminate Octaborate K~3~AlB~8~O~15~
Tanaka, Y.; Fukunaga, J.; Setoguchi, M.; Higashi, T.; Ihara, M.; Journal of the Ceramic Association, Japan 90 (1982) 458–463; doi:10.2109/jcersj1950.90.1044_458

data_1530862
_publ_section_title
;
 The Crystal Structure of Tripotassium Aluminate Octaborate K~3~AlB~8~O~15~
;
_journal_issue                   1044
_journal_name_full               'Journal of the Ceramic Association, Japan'
_journal_page_first              458
_journal_page_last               463
_journal_paper_doi               10.2109/jcersj1950.90.1044_458
_journal_volume                  90
_journal_year                    1982
_chemical_formula_sum            'Al B8 K3 O15'
_chemical_name_systematic        'K3 Al B8 O15'
_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                 91.54
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.107
_cell_length_b                   11.485
_cell_length_c                   12.76
_cell_volume                     1480.632
_citation_journal_id_ASTM        JOCSJY
_cod_data_source_file            Tanaka_JOCSJY_1982_913.cif
_cod_data_source_block           Al1B8K3O15
_cod_original_formula_sum        'Al1 B8 K3 O15'
_cod_database_code               1530862
Sodium chlorite trihydrate
Tarimci, C.; Schempp, E.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 2146–2149; doi:

data_2106731
_publ_section_title
;
 Sodium chlorite trihydrate
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2146
_journal_page_last               2149
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Cl H6 Na O5'
_chemical_name_systematic        'Na (Cl O2) (H2 O)3'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                72.06
_cell_angle_beta                 87.73
_cell_angle_gamma                70.88
_cell_formula_units_Z            2
_cell_length_a                   5.492
_cell_length_b                   6.412
_cell_length_c                   8.832
_cell_volume                     278.921
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Tarimci_ACBCAR_1975_66.cif
_cod_data_source_block           H6Cl1Na1O5
_cod_original_cell_volume        278.9209
_cod_original_formula_sum        'H6 Cl1 Na1 O5'
_cod_database_code               2106731
The electron diffraction analysis of Ga Se
Tatarinova, L.I.; Auleitner, Yu.K.; Pinsker, Z.G.; Kristallografiya 1 (1956) 537–541; doi:

data_1530863
_publ_section_title
;
 The electron diffraction analysis of Ga Se
;
_journal_name_full               Kristallografiya
_journal_page_first              537
_journal_page_last               541
_journal_volume                  1
_journal_year                    1956
_chemical_formula_sum            'Ga Se'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            4
_cell_length_a                   3.75
_cell_length_b                   3.75
_cell_length_c                   15.92
_cell_volume                     193.881
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Tatarinova_KRISAJ_1956_1479.cif
_cod_data_source_block           Ga1Se1
_cod_original_cell_volume        193.8814
_cod_original_formula_sum        'Ga1 Se1'
_cod_database_code               1530863
Crystal structure of the U(IV) heteromolybdate Cu H6 (U Mo12 O42) (H2 O)12
Tat'yanina, I.V.; Chernaya, T.S.; Gorchenkova, E.A.; Spitsyn, V.I.; Simonov, V.I.; Doklady Akademii Nauk SSSR 247 (1979) 1162–1165; doi:

data_1530864
_publ_section_title
;
 Crystal structure of the U(IV) heteromolybdate Cu H6 (U Mo12 O42) (H2
 O)12
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              1162
_journal_page_last               1165
_journal_volume                  247
_journal_year                    1979
_chemical_formula_sum            'Cu H30 Mo12 O54 U'
_chemical_name_systematic        'Cu H6 (U Mo12 O42) (H2 O)12'
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-P 3*'
_symmetry_space_group_name_H-M   'R -3 :R'
_cell_angle_alpha                78.5
_cell_angle_beta                 78.5
_cell_angle_gamma                78.5
_cell_formula_units_Z            1
_cell_length_a                   10.554
_cell_length_b                   10.554
_cell_length_c                   10.554
_cell_volume                     1113.146
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Tatyanina_DANKAS_1979_473.cif
_cod_data_source_block           H30Cu1Mo12O54U1
_cod_original_sg_symbol_Hall     '-R 3 (-y+z,x+z,-x+y+z)'
_cod_original_formula_sum        'H30 Cu1 Mo12 O54 U1'
_cod_database_code               1530864
The deuterium location in deuterium triuranate, D2 U3 O10, by neutron diffraction
Taylor, J.C.; Wilson, P.W.; Acta Crystallographica B (24,1968-38,1982) 30 (1974) 151–154; doi:

data_2106732
_publ_section_title
;
 The deuterium location in deuterium triuranate, D2 U3 O10, by neutron
 diffraction
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              151
_journal_page_last               154
_journal_volume                  30
_journal_year                    1974
_chemical_formula_sum            'D2 O10 U3'
_chemical_name_systematic        'D2 U3 O10'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                108.46
_cell_angle_beta                 125.29
_cell_angle_gamma                88.43
_cell_formula_units_Z            1
_cell_length_a                   6.792
_cell_length_b                   7.416
_cell_length_c                   5.558
_cell_volume                     212.333
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Taylor_ACBCAR_1974_1496.cif
_cod_data_source_block           D2O10U3
_cod_original_cell_volume        212.3325
_cod_database_code               2106732
The structure of uranyl chloride monohydrate by neutron diffraction and the disorder of the water molecule
Taylor, J.C.; Wilson, P.W.; Acta Crystallographica B (24,1968-38,1982) 30 (1974) 169–175; doi:

data_2106733
_publ_section_title
;
 The structure of uranyl chloride monohydrate by neutron diffraction and
 the disorder of the water molecule
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              169
_journal_page_last               175
_journal_volume                  30
_journal_year                    1974
_chemical_formula_sum            'Cl2 H2 O3 U'
_chemical_name_systematic        '(U O2) Cl2 (H2 O)'
_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                 97.79
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.828
_cell_length_b                   8.534
_cell_length_c                   5.557
_cell_volume                     273.833
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Taylor_ACBCAR_1974_1557.cif
_cod_data_source_block           H2Cl2O3U1
_cod_original_cell_volume        273.8332
_cod_original_formula_sum        'H2 Cl2 O3 U1'
_cod_database_code               2106733
The structure of Uranyl Chloride Monohydrate by neutron diffraction and the disorder of the water molecule
Taylor, J.C.; Wilson, P.W.; Acta Crystallographica B (24,1968-38,1982) 30 (1974) 169–175; doi:

data_2106734
_publ_section_title
;
 The structure of Uranyl Chloride Monohydrate by neutron diffraction and
 the disorder of the water molecule
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              169
_journal_page_last               175
_journal_volume                  30
_journal_year                    1974
_chemical_formula_sum            'Cl2 D2 O3 U'
_chemical_name_systematic        'U O2 Cl2 D2 O'
_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                 97.51
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.847
_cell_length_b                   8.596
_cell_length_c                   5.543
_cell_volume                     276.206
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Taylor_ACBCAR_1974_1613.cif
_cod_data_source_block           D2Cl2O3U1
_cod_original_cell_volume        276.2059
_cod_original_formula_sum        'D2 Cl2 O3 U1'
_cod_database_code               2106734
Crystal and molecular structure of molybdenum tetrachloride oxide by neutron and X-Ray diffraction
Taylor, J.C.; Waugh, A.B.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1980 (1980) 2006–2009; doi:

data_4031498
_publ_section_title
;
 Crystal and molecular structure of molybdenum tetrachloride oxide by
 neutron and X-Ray diffraction
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              2006
_journal_page_last               2009
_journal_volume                  1980
_journal_year                    1980
_chemical_formula_sum            'Cl4 Mo O'
_chemical_name_systematic        'Mo O Cl4'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                103.49
_cell_angle_beta                 107.02
_cell_angle_gamma                92.82
_cell_formula_units_Z            2
_cell_length_a                   6.255
_cell_length_b                   7.236
_cell_length_c                   7.134
_cell_volume                     297.827
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Taylor_JCDTBI_1980_575.cif
_cod_data_source_block           Cl4Mo1O1
_cod_original_cell_volume        297.8271
_cod_original_formula_sum        'Cl4 Mo1 O1'
_cod_database_code               4031498
Crystal and molecular structure of molybdenum tetrachloride oxide by neutron and X-Ray diffraction
Taylor, J.C.; Waugh, A.B.; Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1980 (1980) 2006–2009; doi:

data_4031499
_publ_section_title
;
 Crystal and molecular structure of molybdenum tetrachloride oxide by
 neutron and X-Ray diffraction
;
_journal_name_full
;
Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry 
(1972-)
;
_journal_page_first              2006
_journal_page_last               2009
_journal_volume                  1980
_journal_year                    1980
_chemical_formula_sum            'Cl4 Mo O'
_chemical_name_systematic        'Mo O Cl4'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                104.13
_cell_angle_beta                 107.53
_cell_angle_gamma                90.81
_cell_formula_units_Z            2
_cell_length_a                   6.205
_cell_length_b                   6.943
_cell_length_c                   7.249
_cell_volume                     287.483
_citation_journal_id_ASTM        JCDTBI
_cod_data_source_file            Taylor_JCDTBI_1980_588.cif
_cod_data_source_block           Cl4Mo1O1
_cod_original_cell_volume        287.4825
_cod_original_formula_sum        'Cl4 Mo1 O1'
_cod_database_code               4031499