LMucko/crystallography-open-database huggingface dataset:
Direct atomic scale observation of linkage isomerization of As4 S4 clusters during the photoinduced transition of realgar to pararealgar
Naumov, P.; Makreski, P.; Jovanovski, G.; Inorganic Chemistry 46 (2007) 10624–10631; doi:

data_4343883
_publ_section_title
;
 Direct atomic scale observation of linkage isomerization of As4 S4
 clusters during the photoinduced transition of realgar to pararealgar
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              10624
_journal_page_last               10631
_journal_volume                  46
_journal_year                    2007
_chemical_formula_sum            'As4 S4'
_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                 106.242
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.58
_cell_length_b                   13.5288
_cell_length_c                   9.3224
_cell_volume                     796.754
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Naumov_INOCAJ_2007_1452.cif
_cod_data_source_block           As4S4
_cod_original_cell_volume        796.7542
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_database_code               4343883
Crystal chemistry of lithium in octahedrally coordinated structures. I. Synthesis of Ba8 (Me6 Li2) O24 (Me = Nb or Ta) and Ba10 (W6 Li4) O30. II. The tetragonal bronze phase in the system Ba O - Nb2 O5 Li2 O
Negas, T.; Roth, R.S.; Parker, S.; Brower, W.S.; Journal of Solid State Chemistry 8 (1973) 1–13; doi:

data_1528753
_publ_section_title
;
 Crystal chemistry of lithium in octahedrally coordinated structures. I.
 Synthesis of Ba8 (Me6 Li2) O24 (Me = Nb or Ta) and Ba10 (W6 Li4) O30. II.
 The tetragonal bronze phase in the system Ba O - Nb2 O5 Li2 O
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1
_journal_page_last               13
_journal_volume                  8
_journal_year                    1973
_chemical_formula_sum            'Ba4 Li Nb3 O12'
_chemical_name_systematic        'Li Ba4 Nb3 O12'
_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                   5.803
_cell_length_b                   5.803
_cell_length_c                   19.07599
_cell_volume                     556.318
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Negas_JSSCBI_1973_1991.cif
_cod_data_source_block           Ba4Li1Nb3O12
_cod_original_cell_volume        556.3177
_cod_original_formula_sum        'Ba4 Li1 Nb3 O12'
_cod_database_code               1528753
Crystal chemistry of lithium in octahedrally coordinated structures. I. Synthesis of Ba8 (Me6 Li2) O24 (Me = Nb or Ta) and Ba10 (W6 Li4) O30. II. The tetragonal bronze phase in the system Ba O - Nb2 O5 Li2 O
Negas, T.; Roth, R.S.; Brower, W.S.; Parker, S.; Journal of Solid State Chemistry 8 (1973) 1–13; doi:

data_1528754
_publ_section_title
;
 Crystal chemistry of lithium in octahedrally coordinated structures. I.
 Synthesis of Ba8 (Me6 Li2) O24 (Me = Nb or Ta) and Ba10 (W6 Li4) O30. II.
 The tetragonal bronze phase in the system Ba O - Nb2 O5 Li2 O
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1
_journal_page_last               13
_journal_volume                  8
_journal_year                    1973
_chemical_formula_sum            'Ba4 Li O12 Ta3'
_chemical_name_systematic        'Li Ba4 Ta3 O12'
_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                   5.802
_cell_length_b                   5.802
_cell_length_c                   19.08499
_cell_volume                     556.388
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Negas_JSSCBI_1973_1993.cif
_cod_data_source_block           Ba4Li1O12Ta3
_cod_original_cell_volume        556.3883
_cod_original_formula_sum        'Ba4 Li1 O12 Ta3'
_cod_database_code               1528754
Crystal chemistry of lithium in octahedrally coordinated structures. I. Synthesis of Ba8 (Me6 Li2) O24 (Me = Nb or Ta) and Ba10 (W6 Li4) O30. II. The tetragonal bronze phase in the system Ba O - Nb2 O5 Li2 O
Negas, T.; Roth, R.S.; Brower, W.S.; Parker, S.; Journal of Solid State Chemistry 8 (1973) 1–13; doi:

data_1528755
_publ_section_title
;
 Crystal chemistry of lithium in octahedrally coordinated structures. I.
 Synthesis of Ba8 (Me6 Li2) O24 (Me = Nb or Ta) and Ba10 (W6 Li4) O30. II.
 The tetragonal bronze phase in the system Ba O - Nb2 O5 Li2 O
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1
_journal_page_last               13
_journal_volume                  8
_journal_year                    1973
_chemical_formula_sum            'Ba5 Li2 O15 W3'
_chemical_name_systematic        'Li2 Ba5 W3 O15'
_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                   5.76
_cell_length_b                   5.76
_cell_length_c                   23.74199
_cell_volume                     682.170
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Negas_JSSCBI_1973_1994.cif
_cod_data_source_block           Ba5Li2O15W3
_cod_original_cell_volume        682.1702
_cod_database_code               1528755
Ferromagnetism in topochemically pepared layered perovskite Li0.3 Ni0.85 La2 Ti3 O10
Neiner, D.; Spinu, L.; Golub, V.; Wiley, J.B.; Chemistry of Materials (1,1989-) 18 (2006) 518–524; doi:

data_4002416
_publ_section_title
;
 Ferromagnetism in topochemically pepared layered perovskite Li0.3 Ni0.85
 La2 Ti3 O10
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              518
_journal_page_last               524
_journal_volume                  18
_journal_year                    2006
_chemical_formula_sum            'La2 Li0.3 Ni0.85 O10 Ti3'
_chemical_name_systematic        'Li0.3 Ni0.85 La2 Ti3 O10'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.8244
_cell_length_b                   3.8244
_cell_length_c                   26.736
_cell_volume                     391.042
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Neiner_CMATEX_2006_809.cif
_cod_data_source_block           La2Li0.3Ni0.85O10Ti3
_cod_original_cell_volume        391.0417
_cod_database_code               4002416
Structure and properties of mixed valence titanates, (Li(x) V O) La2 Ti3 O10
Neiner, D.; Sweany, R.L.; Golub, V.; Wiley, J.B.; Journal of Materials Chemistry 16 (2006) 186–191; doi:

data_7221496
_publ_section_title
;
 Structure and properties of mixed valence titanates, (Li(x) V O) La2 Ti3
 O10
;
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              186
_journal_page_last               191
_journal_volume                  16
_journal_year                    2006
_chemical_formula_sum            'La2 O10 Ti3 V'
_chemical_name_systematic        'Li1.8 (V O) La2 Ti3 O10'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.85
_cell_length_b                   3.85
_cell_length_c                   26.7861
_cell_volume                     397.037
_citation_journal_id_ASTM        JMACEP
_cod_data_source_file            Neiner_JMACEP_2006_720.cif
_cod_data_source_block           La2O10Ti3V1
_cod_original_formula_sum        'La2 O10 Ti3 V1'
_cod_database_code               7221496
Prototype structure of Pb5 Ge3 O11
Newnham, R.E.; Wolfe, R.W.; Darlington, C.N.W.; Journal of Solid State Chemistry 6 (1973) 378–383; doi:

data_1528756
_publ_section_title
;
 Prototype structure of Pb5 Ge3 O11
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              378
_journal_page_last               383
_journal_volume                  6
_journal_year                    1973
_chemical_formula_sum            'Ge3 O11 Pb5'
_chemical_name_systematic        'Pb5 (Ge O4) (Ge2 O7)'
_space_group_IT_number           174
_symmetry_space_group_name_Hall  'P -6'
_symmetry_space_group_name_H-M   'P -6'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   10.19
_cell_length_b                   10.19
_cell_length_c                   10.642
_cell_volume                     956.979
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Newnham_JSSCBI_1973_1996.cif
_cod_data_source_block           Ge3O11Pb5
_cod_original_cell_volume        956.9786
_cod_database_code               1528756
Etude structurale des polytypes a deux anions L Se F (L= Y, Ho, Er ) . I. Structure cristalline du polytype orthorhombique a six couches du fluoroseleniure d'erbium Er Se F 60
Nguyen, H.D.; Dagron, C.; Laruelle, P.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 514–518; doi:

data_2106572
_publ_section_title
;
 Etude structurale des polytypes a deux anions L Se F (L= Y, Ho, Er ) . I.
 Structure cristalline du polytype orthorhombique a six couches du
 fluoroseleniure d'erbium Er Se F 60
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              514
_journal_page_last               518
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'Er F Se'
_chemical_name_systematic        'Er Se F'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2n'
_symmetry_space_group_name_H-M   'P n a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   9.902
_cell_length_b                   18.7
_cell_length_c                   4.095
_cell_volume                     758.261
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Nguyen_ACBCAR_1975_1911.cif
_cod_data_source_block           Er1F1Se1
_cod_original_cell_volume        758.2605
_cod_original_sg_symbol_Hall     '-P 2ac 2n (-x,z,y)'
_cod_original_formula_sum        'Er1 F1 Se1'
_cod_database_code               2106572
Etude structurale des polytypes a deux anions L Se F (L= Y, Ho, Er ). II. Structure cristalline du fluoroseleniure d'yttrium YSeF, polotype monoclinique a quatre couches 4m
Nguyen, H.D.; Laruelle, P.; Dagron, C.; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 519–521; doi:

data_2106573
_publ_section_title
;
 Etude structurale des polytypes a deux anions L Se F (L= Y, Ho, Er ). II.
 Structure cristalline du fluoroseleniure d'yttrium YSeF, polotype
 monoclinique a quatre couches 4m
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              519
_journal_page_last               521
_journal_volume                  31
_journal_year                    1975
_chemical_formula_sum            'F Se Y'
_chemical_name_systematic        'Y Se F'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2c'
_symmetry_space_group_name_H-M   'P 1 1 21/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                104.92
_cell_formula_units_Z            8
_cell_length_a                   9.962
_cell_length_b                   13.001
_cell_length_c                   4.106
_cell_volume                     513.864
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Nguyen_ACBCAR_1975_1912.cif
_cod_data_source_block           F1Se1Y1
_cod_original_cell_volume        513.8638
_cod_original_sg_symbol_Hall     '-P 2yb (z,x,y)'
_cod_original_formula_sum        'F1 Se1 Y1'
_cod_database_code               2106573
High resolution and in situ neutron powder diffraction study of the crystal structure and the stability of Ba4 Ca Cu3 O(8+delta)
Nguyen, X.H.; Soubeyroux, J.L.; Galez, P.; Bertrand, C.; Pisch, A.; Beauquis, S.; Bouree-Vigneron, F.; Journal of Solid State Chemistry 178 (2005) 3207–3217; doi:

data_1528757
_publ_section_title
;
 High resolution and in situ neutron powder diffraction study of the
 crystal structure and the stability of Ba4 Ca Cu3 O(8+delta)
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              3207
_journal_page_last               3217
_journal_volume                  178
_journal_year                    2005
_chemical_formula_sum            'Ba4 Ca0.92 Cu3 O8.68'
_space_group_IT_number           229
_symmetry_space_group_name_Hall  '-I 4 2 3'
_symmetry_space_group_name_H-M   'I m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.1452
_cell_length_b                   8.1452
_cell_length_c                   8.1452
_cell_volume                     540.387
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Nguyen_JSSCBI_2005_729.cif
_cod_data_source_block           Ba4Ca0.92Cu3O8.68
_cod_original_cell_volume        540.3874
_cod_database_code               1528757
High resolution and in situ neutron powder diffraction study of the crystal structure and the stability of Ba4 Ca Cu3 O(8+delta)
Nguyen, X.H.; Bouree-Vigneron, F.; Galez, P.; Pisch, A.; Soubeyroux, J.L.; Beauquis, S.; Bertrand, C.; Journal of Solid State Chemistry 178 (2005) 3207–3217; doi:

data_1528758
_publ_section_title
;
 High resolution and in situ neutron powder diffraction study of the
 crystal structure and the stability of Ba4 Ca Cu3 O(8+delta)
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              3207
_journal_page_last               3217
_journal_volume                  178
_journal_year                    2005
_chemical_formula_sum            'Ba4 Ca Cu2.93 O7.19'
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.1976
_cell_length_b                   8.1976
_cell_length_c                   8.0709
_cell_volume                     542.370
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Nguyen_JSSCBI_2005_730.cif
_cod_data_source_block           Ba4Ca1Cu2.93O7.19
_cod_original_cell_volume        542.3698
_cod_original_formula_sum        'Ba4 Ca1 Cu2.93 O7.19'
_cod_database_code               1528758
Tuning the decomposition temperature in complex hydrides: synthesis of a mixed alkali metal borohydride
Nickels, E.A.; Johnson, S.R.; Jones, M.O.; David, W.I.F.; Sommariva, M.; Lowton, R.L.; Edwards, P.P.; Angew. Chem. Int. ed. 47 (2008) 2817–2819; doi:

data_1528759
_publ_section_title
;
 Tuning the decomposition temperature in complex hydrides: synthesis of a
 mixed alkali metal borohydride
;
_journal_name_full               'Angew. Chem. Int. ed.'
_journal_page_first              2817
_journal_page_last               2819
_journal_volume                  47
_journal_year                    2008
_chemical_formula_sum            'B2 H8 K Li'
_chemical_name_systematic        'Li K (B H4)2'
_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                   7.91337
_cell_length_b                   4.49067
_cell_length_c                   13.84396
_cell_volume                     491.964
_citation_journal_id_ASTM        ACIEF5
_cod_data_source_file            Nickels_ACIEF5_2008_1374.cif
_cod_data_source_block           H8B2K1Li1
_cod_original_cell_volume        491.9636
_cod_original_formula_sum        'H8 B2 K1 Li1'
_cod_database_code               1528759
Synthesis and structural characterization of several ytterbium bis(trimethylsilyl)amides including base-free [Yb {N (Si Me3)2}2 (mue-Cl)]2 - a coordinatively unsaturated complex with additional agostic Yb...(H3 C-Si) interactions
Niemeyer, M.; Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 647–657; doi:

data_1528760
_publ_section_title
;
 Synthesis and structural characterization of several ytterbium
 bis(trimethylsilyl)amides including base-free [Yb {N (Si Me3)2}2
 (mue-Cl)]2 - a coordinatively unsaturated complex with additional agostic
 Yb...(H3 C-Si) interactions
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              647
_journal_page_last               657
_journal_volume                  628
_journal_year                    2002
_chemical_formula_sum            'C24 H72 Cl2 N4 Si8 Yb2'
_chemical_name_systematic        '(Yb (N (Si (C H3)3)2)2 Cl)2'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                95.529
_cell_angle_beta                 94.803
_cell_angle_gamma                110.142
_cell_formula_units_Z            2
_cell_length_a                   9.0519
_cell_length_b                   11.8046
_cell_length_c                   24.208
_cell_volume                     2398.235
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Niemeyer_ZAACAB_2002_1047.cif
_cod_data_source_block           C24H72Cl2N4Si8Yb2
_cod_database_code               1528760
Synthesis and structural characterization of several ytterbium bis(trimethylsilyl)amides including base-free [Yb {N (Si Me3)2}2 (mue-Cl)]2 - a coordinatively unsaturated complex with additional agostic Yb...(H3 C-Si) interactions
Niemeyer, M.; Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 647–657; doi:

data_1528761
_publ_section_title
;
 Synthesis and structural characterization of several ytterbium
 bis(trimethylsilyl)amides including base-free [Yb {N (Si Me3)2}2
 (mue-Cl)]2 - a coordinatively unsaturated complex with additional agostic
 Yb...(H3 C-Si) interactions
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              647
_journal_page_last               657
_journal_volume                  628
_journal_year                    2002
_chemical_formula_sum            'C18 H54 N3 Si6 Yb'
_chemical_name_systematic        'Yb (N (Si (C H3)3)2)3'
_space_group_IT_number           163
_symmetry_space_group_name_Hall  '-P 3 2c'
_symmetry_space_group_name_H-M   'P -3 1 c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   16.364
_cell_length_b                   16.364
_cell_length_c                   8.536
_cell_volume                     1979.539
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Niemeyer_ZAACAB_2002_1048.cif
_cod_data_source_block           C18H54N3Si6Yb1
_cod_original_formula_sum        'C18 H54 N3 Si6 Yb1'
_cod_database_code               1528761
The coordination chemistry of the mercury(II) in liquid and aqueous ammonia solution and the crystal structure of tetraamminemercury(II) perchlorate
Nilsson, K.B.; Maliarik, M.; Persson, I.; Ullstroem, A.S.; Eriksson, L.; Fischer, A.; Sandstroem, M.; Inorganic Chemistry 47 (2008) 1953–1964; doi:

data_4343884
_publ_section_title
;
 The coordination chemistry of the mercury(II) in liquid and aqueous
 ammonia solution and the crystal structure of tetraamminemercury(II)
 perchlorate
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1953
_journal_page_last               1964
_journal_volume                  47
_journal_year                    2008
_chemical_formula_sum            'Cl2 H12 Hg N4 O8'
_chemical_name_systematic        '(Hg (N H3)4) (Cl O4)2'
_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                   10.8918
_cell_length_b                   8.031
_cell_length_c                   13.847
_cell_volume                     1211.225
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Nilsson_INOCAJ_2008_1408.cif
_cod_data_source_block           H12Cl2Hg1N4O8
_cod_original_formula_sum        'H12 Cl2 Hg1 N4 O8'
_cod_database_code               4343884
Structural change in a series of protonated layered perovskite compounds, H Ln Ti O4 (Ln = La, Nd and Y)
Nishimoto, S.; Ishigaki, T.; Harjo, S.; Matsuda, M.; Kamiyama, T.; Hoshikawa, A.; Miyake, M.; Journal of Solid State Chemistry 179 (2006) 1892–1897; doi:

data_1528762
_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 Nd O4 Ti'
_chemical_name_systematic        'D Nd Ti O4'
_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            2
_cell_length_a                   3.7039
_cell_length_b                   3.7039
_cell_length_c                   12.0883
_cell_volume                     165.838
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Nishimoto_JSSCBI_2006_1167.cif
_cod_data_source_block           D1Nd1O4Ti1
_cod_original_cell_volume        165.8379
_cod_original_sg_symbol_Hall     '-P 4a 2a (x-1/4,y+1/4,z)'
_cod_original_formula_sum        'D1 Nd1 O4 Ti1'
_cod_database_code               1528762