LMucko/crystallography-open-database huggingface dataset:
A phosphoniobate with an intersecting tunnel structure related to pyrochlore: Rb~3~Nb~5~P~2~O/1~9~
Leclaire, A; Borel, M M; Chardon, J; Raveau, B; Journal of Solid State Chemistry 111 (1994) 26–32; doi:10.1006/jssc.1994.1194

data_1001623
_publ_section_title
;
A phosphoniobate with an intersecting tunnel structure related to
pyrochlore: Rb~3~Nb~5~P~2~O/1~9~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              26
_journal_page_last               32
_journal_paper_doi               10.1006/jssc.1994.1194
_journal_volume                  111
_journal_year                    1994
_chemical_formula_structural     'Rb3 (Nb5 P2 O19)'
_chemical_formula_sum            'Nb5 O19 P2 Rb3'
_chemical_name_systematic        'Trirubidium tecto-diphosphatopentaniobate'
_space_group_IT_number           167
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            18
_cell_length_a                   12.989(2)
_cell_length_b                   12.989(2)
_cell_length_c                   53.91199(600)
_cell_volume                     7877.1
_exptl_crystal_density_meas      4.07
_refine_ls_R_factor_all          0.03
_cod_original_sg_symbol_H-M      'R -3 c H'
_cod_database_code               1001623
Structure de Cd4 As2 I3
Gallay, J; Allais, G; Deschanvres, A; Acta Crystallographica B (24,1968-38,1982) 31 (1975) 2274–2276; doi:10.1107/S0567740875007388

data_1001624
_publ_section_title              'Structure de Cd4 As2 I3'
_journal_coden_ASTM              ACBCAR
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2274
_journal_page_last               2276
_journal_paper_doi               10.1107/S0567740875007388
_journal_volume                  31
_journal_year                    1975
_chemical_formula_structural     'Cd4 As2 I3'
_chemical_formula_sum            'As2 Cd4 I3'
_chemical_name_systematic        'Cadmium iodide arsenide (4/3/2)'
_space_group_IT_number           205
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      205
_symmetry_space_group_name_Hall  '-P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P a -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.993(1)
_cell_length_b                   12.993(1)
_cell_length_c                   12.993(1)
_cell_volume                     2193.5
_exptl_crystal_density_meas      5.93(3)
_refine_ls_R_factor_all          0.08
_cod_database_code               1001624
Structure de Cd3 As Cl3 et Donnees Cristallographiques de Cd3 P Cl3
Rebbah, A; Yazbeck, J; Deschanvres, A; Acta Crystallographica B (24,1968-38,1982) 36 (1980) 1744–1746; doi:10.1107/S0567740880007145

data_1001625
_publ_section_title
;
Structure de Cd3 As Cl3 et Donnees Cristallographiques de Cd3 P Cl3
;
_journal_coden_ASTM              ACBCAR
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1744
_journal_page_last               1746
_journal_paper_doi               10.1107/S0567740880007145
_journal_volume                  36
_journal_year                    1980
_chemical_formula_structural     'Cd3 As Cl3'
_chemical_formula_sum            'As Cd3 Cl3'
_chemical_name_systematic        'Tricadmium arsenide trichloride'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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                   13.144(5)
_cell_length_b                   8.102(2)
_cell_length_c                   7.082(3)
_cell_volume                     754.2
_exptl_crystal_density_meas      4.58(3)
_refine_ls_R_factor_all          0.056
_cod_database_code               1001625
Etude structurale des composes Cd3 Y X3 (Y=As, P, X=Cl, Br, I)
Rebbah, A; Yazbeck, J; Deschanvres, A; Revue de Chimie Minerale 18 (1981) 43–53; doi:

data_1001626
_publ_section_title
;
Etude structurale des composes Cd3 Y X3 (Y=As, P, X=Cl, Br, I)
;
_journal_coden_ASTM              RVCMA8
_journal_name_full               'Revue de Chimie Minerale'
_journal_page_first              43
_journal_page_last               53
_journal_volume                  18
_journal_year                    1981
_chemical_formula_structural     'Cd3 P Cl3'
_chemical_formula_sum            'Cd3 Cl3 P'
_chemical_name_systematic        'Tricadmium phosphide trichloride'
_space_group_IT_number           147
_symmetry_cell_setting           trigonal
_symmetry_Int_Tables_number      147
_symmetry_space_group_name_Hall  '-P 3'
_symmetry_space_group_name_H-M   'P -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   7.633(4)
_cell_length_b                   7.633(4)
_cell_length_c                   7.133(3)
_cell_volume                     359.9
_exptl_crystal_density_meas      4.4
_refine_ls_R_factor_all          0.1
_cod_database_code               1001626
Na(x) P4 W14 O50: The sodium m=7 member of the monophosphate tungsten bronze series A(x)(P O2)4 (W O3)2m
Lamire, M; Labbe, P; Goreaud, M; Raveau, B; Journal of Solid State Chemistry 66 (1987) 64–72; doi:10.1016/0022-4596(87)90221-0

data_1001627
_publ_section_title
;
Na(x) P4 W14 O50: The sodium m=7 member of the monophosphate tungsten
bronze series A(x)(P O2)4 (W O3)2m
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              64
_journal_page_last               72
_journal_paper_doi               10.1016/0022-4596(87)90221-0
_journal_volume                  66
_journal_year                    1987
_chemical_formula_structural     'Na1.7 (P O2)4 (W O3)14'
_chemical_formula_sum            'Na1.7 O50 P4 W14'
_chemical_name_systematic        'Sodium phosphate tungstate (1.7/4/14)'
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1 (-x,-1/2*y+1/2*z,1/2*y+1/2*z)'
_symmetry_space_group_name_H-M   'A -1'
_cell_angle_alpha                89.62(1)
_cell_angle_beta                 96.17(1)
_cell_angle_gamma                90.26(1)
_cell_formula_units_Z            1
_cell_length_a                   6.575(2)
_cell_length_b                   5.304(1)
_cell_length_c                   27.07599(300)
_cell_volume                     938.7
_refine_ls_R_factor_all          0.036
_cod_database_code               1001627
A new silver molybdenum(V) phosphate: ξ-Ag(MoO)~2~(P~2~O~7~)(PO~4~)
Hoareau, T.; Borel, M.-M.; Grandin, A.; Leclaire, A.; Raveau, B.; Comptes Rendus de l'Academie des Sciences, Serie IIb: Mecanique, Physique, Chimie, Astronomie 319 (1994) 47–52; doi:

data_1001628
_publ_section_title
;
 A new silver molybdenum(V) phosphate: \x-Ag(MoO)~2~(P~2~O~7~)(PO~4~)
;
_journal_coden_ASTM              CMCAEK
_journal_name_full
;
 Comptes Rendus de l'Academie des Sciences, Serie IIb: Mecanique, Physique,
 Chimie, Astronomie
;
_journal_page_first              47
_journal_page_last               52
_journal_volume                  319
_journal_year                    1994
_chemical_formula_structural     'Ag (Mo O)2 (P2 O7) (P O4)'
_chemical_formula_sum            'Ag Mo2 O13 P3'
_chemical_name_systematic
;
Silver dimolybdo(V) diphosphate phosphate - \x
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 126.1(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.376(2)
_cell_length_b                   22.17299(200)
_cell_length_c                   8.718(2)
_cell_volume                     995.9
_refine_ls_R_factor_all          0.022
_cod_database_code               1001628
Mixed valent iron oxides with the 0201-1201 intergrowth structure: (Pb1- x Tlx) Sr4 Fe2 O9 (0<x<1)
Daniel, P; Barbey, L; Groult, D; Nguyen, N; Van Tendeloo, G; Raveau, B; European Journal of Solid State Inorganic Chemistry 31 (1994) 235–244; doi:

data_1001629
_publ_section_title
;
Mixed valent iron oxides with the 0201-1201 intergrowth structure: (Pb1-
x Tlx) Sr4 Fe2 O9 (0<x<1)
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              235
_journal_page_last               244
_journal_volume                  31
_journal_year                    1994
_chemical_formula_structural     'Tl0.965 Sr4 Fe2 O9'
_chemical_formula_sum            'Fe2 O9 Sr4 Tl0.965'
_chemical_name_systematic        'Thallium strontium iron oxide (0.97/4/2/9)'
_space_group_IT_number           139
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_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                   3.8048
_cell_length_b                   3.8048
_cell_length_c                   30.46799
_cell_volume                     441.1
_refine_ls_R_factor_all          0.1
_cod_original_formula_sum        'Fe2 O9 Sr4 Tl.965'
_cod_database_code               1001629
A zeolitic mixed valence molybdenum monophosphate with a tunnel structure: Cs8+x (Mo O4) Mo12 O18 (P O4)10 .(H2 O)
Hoareau, T; Leclaire, A; Borel, M - M; Grandin, A; Raveau, B; European Journal of Solid State Inorganic Chemistry 31 (1994) 727–737; doi:

data_1001630
_publ_section_title
;
A zeolitic mixed valence molybdenum monophosphate with a tunnel
structure: Cs8+x (Mo O4) Mo12 O18 (P O4)10 .(H2 O)
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
European Journal of Solid State Inorganic Chemistry
;
_journal_page_first              727
_journal_page_last               737
_journal_volume                  31
_journal_year                    1994
_chemical_formula_structural     'Cs8.35 ((Mo O4) Mo12 O18 (P O4)10) (H2 O)'
_chemical_formula_sum            'Cs8.35 H2 Mo13 O63 P10'
_chemical_name_systematic
;
Caesium molybdenum phosphorus oxide hydrate (8.35/13/10/62/1)
;
_space_group_IT_number           176
_symmetry_cell_setting           hexagonal
_symmetry_Int_Tables_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                   16.67799(300)
_cell_length_b                   16.67799(300)
_cell_length_c                   12.717(3)
_cell_volume                     3063.4
_refine_ls_R_factor_all          0.054
_cod_original_formula_sum        'H2 Cs8.35 Mo13 O63 P10'
_cod_database_code               1001630
Lead-mercury-based superconductors. The 1212 cuprate Pb0.7 Hg0.3 Sr2+x Ca0.7 Nd0.3-x Cu2 O7-d and the new oxycarbonate Pb0.7 Hg0.3 Sr4 Cu2 (C O3) O7
Martin, C; Hervieu, M; Huve, M; Michel, C; Maignan, A; Van Tendeloo, G; Raveau, B; Physica C (Amsterdam) (152,1988-) 222 (1994) 19–26; doi:10.1016/0921-4534(94)90109-0

data_1001631
_publ_section_title
;
Lead-mercury-based superconductors. The 1212 cuprate Pb0.7 Hg0.3 Sr2+x
Ca0.7 Nd0.3-x Cu2 O7-d and the new oxycarbonate Pb0.7 Hg0.3 Sr4 Cu2 (C
O3) O7
;
_journal_coden_ASTM              PHYCE6
_journal_name_full               'Physica C (Amsterdam) (152,1988-)'
_journal_page_first              19
_journal_page_last               26
_journal_paper_doi               10.1016/0921-4534(94)90109-0
_journal_volume                  222
_journal_year                    1994
_chemical_formula_structural     '(Pb0.7 Hg0.3) Sr2 (Nd0.23 Ca0.77) Cu2 O7'
_chemical_formula_sum            'Ca0.77 Cu2 Hg0.3 Nd0.23 O7 Pb0.7 Sr2'
_chemical_name_systematic
;
Lead mercury strontium neodymium calcium copper oxide
(0.7/0.3/2/0.2/0.8/2/7)
;
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_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            1
_cell_length_a                   3.8116(2)
_cell_length_b                   3.8116(2)
_cell_length_c                   12.1337(6)
_cell_volume                     176.3
_refine_ls_R_factor_all          0.087
_cod_original_formula_sum        'Ca.77 Cu2 Hg.3 Nd.23 O7 Pb.7 Sr2'
_cod_database_code               1001631
Lead-mercury-based superconductors. The 1212 cuprate Pb0.7 Hg0.3 Sr2+x Ca0.7 Nd0.3-x Cu2 O7-d and the new oxycarbonate Pb0.7 Hg0.3 Sr4 Cu2 (C O3) O7
Martin, C; Hervieu, M; Huve, M; Michel, C; Maignan, A; Van Tendeloo, G; Raveau, B; Physica C (Amsterdam) (152,1988-) 222 (1994) 19–26; doi:10.1016/0921-4534(94)90109-0

data_1001632
_publ_section_title
;
Lead-mercury-based superconductors. The 1212 cuprate Pb0.7 Hg0.3 Sr2+x
Ca0.7 Nd0.3-x Cu2 O7-d and the new oxycarbonate Pb0.7 Hg0.3 Sr4 Cu2 (C
O3) O7
;
_journal_coden_ASTM              PHYCE6
_journal_name_full               'Physica C (Amsterdam) (152,1988-)'
_journal_page_first              19
_journal_page_last               26
_journal_paper_doi               10.1016/0921-4534(94)90109-0
_journal_volume                  222
_journal_year                    1994
_chemical_formula_structural     '(Pb0.7 Hg0.3) Sr4 Cu2 (C O3) O7'
_chemical_formula_sum            'C Cu2 Hg0.3 O10 Pb0.7 Sr4'
_chemical_name_systematic
;
Lead mercury strontium copper carbonate oxide (0.7/0.3/4/2/1/7)
;
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_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            1
_cell_length_a                   3.8242(1)
_cell_length_b                   3.8242(1)
_cell_length_c                   16.46809(40)
_cell_volume                     240.8
_refine_ls_R_factor_all          0.074
_cod_depositor_comments
;
 Correcting the summary chemical formula by changing it from
 'Cu2 Hg0.3 O10 Pb0.7 Sr4' to 'C Cu2 Hg0.3 O10 Pb0.7 Sr4'.

 Antanas Vaitkus,
 2018-07-07
;
_cod_original_formula_sum        'Cu2 Hg.3 O10 Pb.7 Sr4'
_cod_database_code               1001632
A new superconducting oxycarbonate Bi0.5 Hg0.5 Sr4 Cu2 (C O3) O7-d
Pelloquin, D; Hervieu, M; Michel, C; Maignan, A; Raveau, B; Physica C (Amsterdam) (152,1988-) 227 (1994) 215–224; doi:10.1016/0921-4534(94)90074-4

data_1001633
_publ_section_title
;
A new superconducting oxycarbonate Bi0.5 Hg0.5 Sr4 Cu2 (C O3) O7-d
;
_journal_coden_ASTM              PHYCE6
_journal_name_full               'Physica C (Amsterdam) (152,1988-)'
_journal_page_first              215
_journal_page_last               224
_journal_paper_doi               10.1016/0921-4534(94)90074-4
_journal_volume                  227
_journal_year                    1994
_chemical_formula_structural
;
(Hg0.5 Bi0.5) Sr4 Cu2 ((C O3)0.955 Hg0.045) O6.855
;
_chemical_formula_sum            'C0.955 Bi0.5 Cu2 Hg0.545 O9.72 Sr4'
_chemical_name_systematic
;
Mercury bismuth strontium copper carbonate oxide (0.5/0.5/4/2/1/6.86)
;
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_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            1
_cell_length_a                   3.8265(1)
_cell_length_b                   3.8265(1)
_cell_length_c                   16.4742(6)
_cell_volume                     241.2
_refine_ls_R_factor_all          0.069
_cod_depositor_comments
;
 Correcting the summary chemical formula by changing it from
 'Bi0.5 Cu2 Hg0.545 O9.72 Sr4' to 'C0.955 Bi0.5 Cu2 Hg0.545 O9.72 Sr4'.

 Antanas Vaitkus,
 2018-07-07
;
_cod_original_formula_sum        'Bi.5 Cu2 Hg.545 O9.72 Sr4'
_cod_database_code               1001633
(Tl, Bi) Sr2 Ca Cu2 O7 "1212" superconducting single crystal. A structural and magnetic study
Ledesert, M; Maignan, A; Chardon, J; Martin, C; Labbe, Ph; Hervieu, M; Raveau, B; Physica C (Amsterdam) (152,1988-) 232 (1994) 387–395; doi:10.1016/0921-4534(94)90798-6

data_1001634
_publ_section_title
;
(Tl, Bi) Sr2 Ca Cu2 O7 "1212" superconducting single crystal. A
structural and magnetic study
;
_journal_coden_ASTM              PHYCE6
_journal_name_full               'Physica C (Amsterdam) (152,1988-)'
_journal_page_first              387
_journal_page_last               395
_journal_paper_doi               10.1016/0921-4534(94)90798-6
_journal_volume                  232
_journal_year                    1994
_chemical_formula_structural     '(Tl0.67 Bi0.33) (Ca0.89 Tl0.11) Sr2 Cu2 O7'
_chemical_formula_sum            'Bi0.33 Ca0.89 Cu2 O7 Sr2 Tl0.78'
_chemical_name_systematic
;
Thallium bismuth calcium strontium copper oxide (0.78/0.33/0.89/2/2/7)
;
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_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            1
_cell_length_a                   3.7922(6)
_cell_length_b                   3.7922(6)
_cell_length_c                   12.0661(25)
_cell_volume                     173.5
_refine_ls_R_factor_all          0.025
_cod_original_formula_sum        'Bi.33 Ca.89 Cu2 O7 Sr2 Tl.78'
_cod_database_code               1001634
Structure and antiferromagnetic properties of a mixed valent molybdeno monophosphate of lithium
Hoareau, T; Borel, M M; Leclaire, A; Provost, J; Raveau, B; Materials Research Bulletin 30 (1995) 523–529; doi:10.1016/0025-5408(95)00023-2

data_1001635
_publ_section_title
;
Structure and antiferromagnetic properties of a mixed valent molybdeno
monophosphate of lithium
;
_journal_coden_ASTM              MRBUAC
_journal_issue                   4
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              523
_journal_page_last               529
_journal_paper_doi               10.1016/0025-5408(95)00023-2
_journal_volume                  30
_journal_year                    1995
_chemical_formula_structural     'Li (Mo2 Mo P3 O16)'
_chemical_formula_sum            'Li Mo3 O16 P3'
_chemical_name_systematic        'Lithium dimolybdo(V)molybdotriphosphate'
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                80.03(1)
_cell_angle_beta                 77.62(1)
_cell_angle_gamma                81.80(1)
_cell_formula_units_Z            2
_cell_length_a                   6.374(1)
_cell_length_b                   7.709(1)
_cell_length_c                   12.529(1)
_cell_volume                     588.7
_refine_ls_R_factor_all          0.027
_cod_database_code               1001635
Two transition-metal-substituted superconducting mercury-based oxycarbonates, Hg(1-x) Mx Sr4 Cu2 (C O3) O(6+d) (M=Cr and Mo)
Pelloquin, D; Hervieu, M; Malo, S; Michel, C; Maignan, A; Raveau, B; Physica C (Amsterdam) (152,1988-) 246 (1995) 1–10; doi:10.1016/0921-4534(95)00131-X

data_1001636
_publ_section_title
;
Two transition-metal-substituted superconducting mercury-based
oxycarbonates, Hg(1-x) Mx Sr4 Cu2 (C O3) O(6+d) (M=Cr and Mo)
;
_journal_coden_ASTM              PHYCE6
_journal_name_full               'Physica C (Amsterdam) (152,1988-)'
_journal_page_first              1
_journal_page_last               10
_journal_paper_doi               10.1016/0921-4534(95)00131-X
_journal_volume                  246
_journal_year                    1995
_chemical_formula_structural     '(Hg0.52 Mo0.48) Sr4 Cu2 (C O3) O6.21'
_chemical_formula_sum            'C Cu2 Hg0.52 Mo0.48 O9.21 Sr4'
_chemical_name_systematic
;
Mercury molybdenum strontium copper carbonate oxide (0.5/0.5/4/2/1/6.21)
;
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_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            1
_cell_length_a                   3.8448(1)
_cell_length_b                   3.8448(1)
_cell_length_c                   16.31729(70)
_cell_volume                     241.2
_refine_ls_R_factor_all          0.1
_cod_depositor_comments
;
 Correcting the summary chemical formula by changing it from
 'Cu2 Hg0.52 Mo0.48 O9.21 Sr4' to 'C Cu2 Hg0.52 Mo0.48 O9.21 Sr4'.

 Antanas Vaitkus,
 2018-07-07
;
_cod_original_formula_sum        'Cu2 Hg.52 Mo.48 O9.21 Sr4'
_cod_database_code               1001636
Two transition-metal-substituted superconducting mercury-based oxycarbonates, Hg(1-x) Mx Sr4 Cu2 (C O3) O(6+d) (M=Cr and Mo)
Pelloquin, D; Hervieu, M; Malo, S; Michel, C; Maignan, A; Raveau, B; Physica C (Amsterdam) (152,1988-) 246 (1995) 1–10; doi:10.1016/0921-4534(95)00131-X

data_1001637
_publ_section_title
;
Two transition-metal-substituted superconducting mercury-based
oxycarbonates, Hg(1-x) Mx Sr4 Cu2 (C O3) O(6+d) (M=Cr and Mo)
;
_journal_coden_ASTM              PHYCE6
_journal_name_full               'Physica C (Amsterdam) (152,1988-)'
_journal_page_first              1
_journal_page_last               10
_journal_paper_doi               10.1016/0921-4534(95)00131-X
_journal_volume                  246
_journal_year                    1995
_chemical_formula_structural     '(Hg0.46 Cr0.54) Sr4 Cu2 (C O3) O6.88'
_chemical_formula_sum            'C Cr0.54 Cu2 Hg0.46 O9.88 Sr4'
_chemical_name_systematic
;
Mercury chromium strontium copper carbonate oxide (0.46/0.54/4/2/1/6.88)
;
_space_group_IT_number           123
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_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            1
_cell_length_a                   3.8747(1)
_cell_length_b                   3.8747(1)
_cell_length_c                   16.15549(60)
_cell_volume                     242.5
_refine_ls_R_factor_all          0.1
_cod_depositor_comments
;
 Correcting the summary chemical formula by changing it from
 'Cr0.54 Cu2 Hg0.46 O9.88 Sr4' to 'C Cr0.54 Cu2 Hg0.46 O9.88 Sr4'.

 Antanas Vaitkus,
 2018-07-07
;
_cod_original_formula_sum        'Cr.54 Cu2 Hg.46 O9.88 Sr4'
_cod_database_code               1001637