LMucko/crystallography-open-database huggingface dataset:
Crystal structure and magnetic properties of NaBa2Mn3F11 : a new layer-type fluoride compound
Darriet, J.; Ducau, M.; Feist, M.; Tressaud, A.; Hagenmuller, P.; Journal of Solid State Chemistry 98 (1992) 379–385; doi:10.1016/S0022-4596(05)80248-8

data_1545916
_publ_section_title
;
 Crystal structure and magnetic properties of NaBa2Mn3F11 : a new
 layer-type fluoride compound
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              379
_journal_page_last               385
_journal_paper_doi               10.1016/S0022-4596(05)80248-8
_journal_volume                  98
_journal_year                    1992
_chemical_formula_sum            'Ba2 F11 Mn3 Na'
_chemical_formula_weight         671.47
_space_group_IT_number           167
_symmetry_cell_setting           trigonal
_symmetry_Int_Tables_number      167
_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            6
_cell_length_a                   7.003(1)
_cell_length_b                   7.003(1)
_cell_length_c                   35.466(6)
_cell_volume                     1506.3(4)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    10.97
_exptl_crystal_density_diffrn    4.44
_exptl_crystal_density_meas      4.39
_exptl_crystal_F_000             1782
_refine_ls_goodness_of_fit_ref   2.193
_refine_ls_number_reflns         316
_refine_ls_R_factor_gt           0.0317
_refine_ls_wR_factor_gt          0.0297
_cod_data_source_file            JSSC-1992-98-379-385.cif
_cod_data_source_block           NaBa2Mn3F11
_cod_depositor_comments
;
When F1 in 18e position the coordinates are :
x  =  0.2433(9)
y  =  0
z  =  0.75

and the Uij are :
U11 = 0.0453(29)
U22 = 0.1470(89)
U33 = 0.0131(53)
U23 = -0.0031(53)
U13 = U23/2
U12 = U11/2
;
_cod_original_cell_volume        1506.3(6)
_cod_original_sg_symbol_H-M      'R -3 c'
_cod_database_code               1545916
Synthesis and crystal structure of Ca(VO)2(PO4)2
Lii, K. H.; Chueh, B. R.; Kang, H. Y.; Wang, S. L.; Journal of Solid State Chemistry 99 (1992) 72–77; doi:10.1016/0022-4596(92)90290-C

data_1545917
_publ_section_title
;
 Synthesis and crystal structure of Ca(VO)2(PO4)2
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              72
_journal_page_last               77
_journal_paper_doi               10.1016/0022-4596(92)90290-C
_journal_volume                  99
_journal_year                    1992
_chemical_formula_sum            'Ca O10 P2 V2'
_chemical_formula_weight         363.903
_space_group_IT_number           43
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      43
_symmetry_space_group_name_Hall  'F 2 -2d'
_symmetry_space_group_name_H-M   'F d d 2'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            8
_cell_length_a                   11.795(4)
_cell_length_b                   15.784(6)
_cell_length_c                   7.190(4)
_cell_volume                     1338.6(10)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    3.974
_exptl_crystal_density_diffrn    3.612
_refine_ls_goodness_of_fit_ref   0.931
_refine_ls_number_parameters     44
_refine_ls_number_reflns         322
_refine_ls_R_factor_gt           0.0346
_refine_ls_wR_factor_gt          0.0346
_cod_data_source_file            JSSC-1992-99-72-77.cif
_cod_data_source_block           Ca(VO)2(PO4)2
_cod_database_code               1545917
Simulation and Experimental data of P-E Hysteresis Loop in BNT and BKT
Mahmood, Natheer B.; Al-Shakarchi, Emad K.; Journal of Modern Physics 8 (2017) 844–851; doi:10.4236/jmp.2017.85053

data_1545918
_publ_section_title
;
 Simulation and Experimental data of P-E Hysteresis Loop in BNT and BKT
;
_journal_coden_ASTM              JMPOCW
_journal_issue                   5
_journal_name_full               'Journal of Modern Physics'
_journal_page_first              844
_journal_page_last               851
_journal_paper_doi               10.4236/jmp.2017.85053
_journal_volume                  8
_journal_year                    2017
_chemical_formula_analytical     Bi0.5Na0.5TiO3
_chemical_formula_structural     Bi0.5Na0.5TiO3
_chemical_formula_sum            'Bi0.5 Na0.5 O9 Ti'
_chemical_formula_weight         307.860
_chemical_formula_weight_meas    211.850
_chemical_melting_point          1543.000
_chemical_name_common            'Bismuth Sodium Titanate'
_chemical_name_systematic        BNT
_space_group_IT_number           161
_symmetry_Int_Tables_number      161
_symmetry_space_group_name_Hall  'R 3 -2"c'
_symmetry_space_group_name_H-M   'R 3 c :H'
_audit_creation_date             2017-05-04
_audit_creation_method
'Created with CONVERT.DLL (www.crystalimpact.com)'
_audit_update_record             2017-05-04
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                120.000
_cell_formula_units_Z            6
_cell_length_a                   5.4900
_cell_length_b                   5.4900
_cell_length_c                   13.3870
_cell_volume                     349.429
_exptl_crystal_density_meas      5.990
_refine_ls_R_factor_all          1.000
_refine_ls_R_factor_obs          1.000
_cod_data_source_file            BNTR3c.cif
_cod_data_source_block           BNT
_cod_original_cell_volume        349.4
_cod_original_sg_symbol_Hall     R_3_-2"c
_cod_original_sg_symbol_H-M      'R 3 c'
_cod_original_formula_sum        'Na0.5 Bi0.5 Ti O9'
_cod_database_code               1545918
Simulation and Experimental data of P-E Hysteresis Loop in BNT and BKT
Mahmood, Natheer B.; Al-Shakarchi, Emad K.; Journal of Modern Physics 8 (2017) 844–851; doi:10.4236/jmp.2017.85053

data_1545919
_publ_section_title
;
 Simulation and Experimental data of P-E Hysteresis Loop in BNT and BKT
;
_journal_coden_ASTM              JMPOCW
_journal_issue                   5
_journal_name_full               'Journal of Modern Physics'
_journal_page_first              844
_journal_page_last               851
_journal_paper_doi               10.4236/jmp.2017.85053
_journal_volume                  8
_journal_year                    2017
_chemical_formula_analytical     Bi0.5K0.5TiO3
_chemical_formula_structural     Bi0.5K0.5TiO3
_chemical_formula_sum            'Bi0.5 K0.5 O3 Ti'
_chemical_formula_weight         219.918
_chemical_formula_weight_meas    219.900
_chemical_melting_point          1433.000
_chemical_name_common            Bi0.5K0.5TiO3
_chemical_name_mineral           BKT
_space_group_IT_number           99
_symmetry_Int_Tables_number      99
_symmetry_space_group_name_Hall  'P 4 -2'
_symmetry_space_group_name_H-M   'P 4 m m'
_audit_creation_date             2017-05-04
_audit_creation_method
'Created with CONVERT.DLL (www.crystalimpact.com)'
_audit_update_record             2017-05-04
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_formula_units_Z            1
_cell_length_a                   3.9071
_cell_length_b                   3.9071
_cell_length_c                   3.9571
_cell_volume                     60.407
_exptl_crystal_density_meas      5.927
_cod_data_source_file            BKTP4MM.cif
_cod_data_source_block           BKT
_cod_original_cell_volume        60.4
_cod_original_sg_symbol_Hall     P_4_-2
_cod_original_formula_sum        'Bi0.5 K0.5 Ti O3'
_cod_database_code               1545919
Electronic Structure and Magnetic Anisotropy in Lanthanoid Single-Ion Magnets with C3 Symmetry: The Ln(trenovan) Series.
Lucaccini, Eva; Baldoví, José J; Chelazzi, Laura; Barra, Anne-Laure; Grepioni, Fabrizia; Costes, Jean-Pierre; Sorace, Lorenzo; Inorganic chemistry 56 (2017) 4729–4739; doi:10.1021/acs.inorgchem.7b00413

data_4345777
_publ_section_title
;
 Electronic Structure and Magnetic Anisotropy in Lanthanoid Single-Ion
 Magnets with C3 Symmetry: The Ln(trenovan) Series.
;
_journal_issue                   8
_journal_name_full               'Inorganic chemistry'
_journal_page_first              4729
_journal_page_last               4739
_journal_paper_doi               10.1021/acs.inorgchem.7b00413
_journal_volume                  56
_journal_year                    2017
_chemical_formula_moiety         'C30 H33 N4 O6 Pr1'
_chemical_formula_sum            'C30 H33 N4 O6 Pr'
_chemical_formula_weight         686.5
_chemical_name_common            Prtrenovan
_space_group_IT_number           147
_symmetry_cell_setting           trigonal
_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                   14.456(1)
_cell_length_b                   14.456(1)
_cell_length_c                   7.887(1)
_cell_measurement_reflns_used    15
_cell_measurement_temperature    293
_cell_measurement_theta_max      25
_cell_measurement_theta_min      1.5
_cell_volume                     1427.4(2)
_computing_cell_refinement       'TOPAS (Coelho ,2007)'
_computing_data_collection       'Highscore plus'
_computing_structure_refinement  'TOPAS (Coelho ,2007)'
_computing_structure_solution    'EXPO2013 (Altomare, 2013)'
_diffrn_ambient_temperature      293
_diffrn_measurement_device_type  char
_diffrn_radiation_monochromator  'Ge filtered'
_diffrn_radiation_type           'Cu K\a'
_diffrn_radiation_wavelength     1.54175
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.597
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             696.0
_pd_proc_2theta_range_max        60
_pd_proc_2theta_range_min        4
_pd_proc_info_excluded_regions   no
_pd_proc_ls_background_function  Chebyschev
_pd_proc_ls_pref_orient_corr
;
Spherical Harmonics
;
_pd_proc_ls_prof_R_factor        0.056
_pd_proc_ls_prof_wR_expected     0.037
_pd_proc_ls_prof_wR_factor       0.074
_pd_spec_mounting
;
0.5 mm borosilicate glass capillary
;
_pd_spec_mount_mode              transmission
_pd_spec_shape                   cylinder
_refine_ls_goodness_of_fit_all   1.98
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     39
_refine_ls_structure_factor_coef Fsqd
_cod_data_source_file            ic7b00413_si_004.cif
_cod_data_source_block           Prtrenovan
_cod_original_cell_volume        1427.3(3)
_cod_original_sg_symbol_H-M      P-3
_cod_original_formula_sum        'C30 H33 N4 O6 Pr1'
_cod_database_code               4345777
Polymorphisme et structure cristalline de ThV2O7
Launay, S.; Mahe, P.; Quarton, M.; Robert, F.; Journal of Solid State Chemistry 97 (1992) 305–313; doi:10.1016/0022-4596(92)90038-W

data_1545921
_publ_section_title
;
 Polymorphisme et structure cristalline de ThV2O7
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              305
_journal_page_last               313
_journal_paper_doi               10.1016/0022-4596(92)90038-W
_journal_volume                  97
_journal_year                    1992
_chemical_formula_sum            'O7 Th V2'
_chemical_formula_weight         445.917
_space_group_IT_number           33
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      33
_symmetry_space_group_name_Hall  'P -2ac -2n'
_symmetry_space_group_name_H-M   'P n 21 a'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            8
_cell_length_a                   7.201(1)
_cell_length_b                   22.771(1)
_cell_length_c                   6.945(1)
_cell_volume                     1138.8(2)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    30.07
_exptl_crystal_density_diffrn    5.202
_exptl_crystal_F_000             1536
_refine_ls_number_reflns         1506
_refine_ls_R_factor_gt           0.030
_refine_ls_wR_factor_gt          0.034
_cod_data_source_file            JSSC-1992-97-305-313.cif
_cod_data_source_block           ThV2O7
_cod_depositor_comments
;
In Pnma : R = 0.048 and Rw = 0.076
;
_cod_database_code               1545921
The crystal structure of Na2CoFeF7 and a second modification of Na2CuFeF7 : another weberite variant
Matthias Welsch; Dietrich Babel; Zeitschrift fur Naturforschung  (1992) 685–692; doi:10.1515/znb-1992-0513

data_7228193
_publ_section_title
;
 The crystal structure of Na2CoFeF7 and a second modification of Na2CuFeF7
 : another weberite variant
;
_journal_name_full               'Zeitschrift fur Naturforschung'
_journal_page_first              685
_journal_page_last               692
_journal_paper_doi               10.1515/znb-1992-0513
_journal_volume                  47b
_journal_year                    1992
_chemical_formula_sum            'Co F7 Fe Na2'
_chemical_formula_weight         293.75
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.
_cell_angle_beta                 99.71(5)
_cell_angle_gamma                90.
_cell_formula_units_Z            16
_cell_length_a                   12.622(6)
_cell_length_b                   7.360(4)
_cell_length_c                   24.516(20)
_cell_volume                     2245(2)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    5.53
_exptl_crystal_density_diffrn    3.477
_refine_ls_goodness_of_fit_ref   1.742
_refine_ls_number_reflns         1005
_refine_ls_R_factor_all          0.0652
_refine_ls_R_factor_gt           0.0362
_refine_ls_wR_factor_gt          0.0431
_cod_data_source_file            Z-Naturforsch--1992-47b-685-692-1.cif
_cod_data_source_block           Na2CoFeF7
_cod_original_cell_volume        2249.9(29)
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               7228193
The crystal structure of Na2CoFeF7 and a second modification of Na2CuFeF7 : another weberite variant
Matthias Welsch; Dietrich Babel; Zeitschrift fur Naturforschung  (1992) 685–692; doi:10.1515/znb-1992-0513

data_7228194
_publ_section_title
;
 The crystal structure of Na2CoFeF7 and a second modification of Na2CuFeF7
 : another weberite variant
;
_journal_name_full               'Zeitschrift fur Naturforschung'
_journal_page_first              685
_journal_page_last               692
_journal_paper_doi               10.1515/znb-1992-0513
_journal_volume                  47b
_journal_year                    1992
_chemical_formula_sum            'Cu F7 Fe Na2'
_chemical_formula_weight         298.36
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.
_cell_angle_beta                 99.27(3)
_cell_angle_gamma                90.
_cell_formula_units_Z            16
_cell_length_a                   12.444(2)
_cell_length_b                   7.343(1)
_cell_length_c                   24.672(5)
_cell_volume                     2225.0(7)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    6.67
_exptl_crystal_density_diffrn    3.563
_refine_ls_goodness_of_fit_ref   1.830
_refine_ls_number_reflns         1790
_refine_ls_R_factor_all          0.0982
_refine_ls_R_factor_gt           0.0405
_refine_ls_wR_factor_gt          0.0614
_cod_data_source_file            Z-Naturforsch--1992-47b-685-692-2.cif
_cod_data_source_block           Na2CuFeF7-II
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               7228194
High-Pressure Synthesis and Structure Refinement of SrVO3, Sr2VO4, and Sr3V2O7
Klaus-Jurgen Range; Franz Rau; Ulrich Klement; Zeitschrift fur Naturforschung B 46 (1991) 1315–1318; doi:10.1515/znb-1991-1006

data_7228251
_publ_section_title
;
 High-Pressure Synthesis and Structure Refinement of SrVO3, Sr2VO4, and
 Sr3V2O7
;
_journal_name_full               'Zeitschrift fur Naturforschung B'
_journal_page_first              1315
_journal_page_last               1318
_journal_paper_doi               10.1515/znb-1991-1006
_journal_volume                  46
_journal_year                    1991
_chemical_formula_sum            'O4 Sr2 V'
_chemical_formula_weight         290.179
_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                   3.837(1)
_cell_length_b                   3.837(1)
_cell_length_c                   12.569(3)
_cell_volume                     185.05(8)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.5418
_exptl_absorpt_coefficient_mu    5.72
_exptl_crystal_density_diffrn    5.21
_exptl_crystal_F_000             262
_refine_ls_number_parameters     13
_refine_ls_number_reflns         68
_refine_ls_R_factor_gt           0.014
_refine_ls_wR_factor_gt          0.017
_cod_data_source_file            Z-Naturforsch-1991-46b-1315-1318-1.cif
_cod_data_source_block           Sr2VO4
_cod_original_cell_volume        185.04(3)
_cod_database_code               7228251
High-Pressure Synthesis and Structure Refinement of SrVO3, Sr2VO4, and Sr3V2O7
Klaus-Jurgen Range; Franz Rau; Ulrich Klement; Zeitschrift fur Naturforschung B 46 (1991) 1315–1318; doi:10.1515/znb-1991-1006

data_7228252
_publ_section_title
;
 High-Pressure Synthesis and Structure Refinement of SrVO3, Sr2VO4, and
 Sr3V2O7
;
_journal_name_full               'Zeitschrift fur Naturforschung B'
_journal_page_first              1315
_journal_page_last               1318
_journal_paper_doi               10.1515/znb-1991-1006
_journal_volume                  46
_journal_year                    1991
_chemical_formula_moiety         'O7 V2, 3(Sr)'
_chemical_formula_sum            'O7 Sr3 V2'
_chemical_formula_weight         476.739
_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                   3.839(1)
_cell_length_b                   3.839(1)
_cell_length_c                   20.262(2)
_cell_volume                     298.62(11)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.5418
_exptl_absorpt_coefficient_mu    6.66
_exptl_crystal_density_diffrn    5.30
_exptl_crystal_F_000             432
_refine_ls_number_parameters     19
_refine_ls_number_reflns         109
_refine_ls_R_factor_gt           0.020
_refine_ls_wR_factor_gt          0.029
_cod_data_source_file            Z-Naturforsch-1991-46b-1315-1318-2.cif
_cod_data_source_block           Sr3V2O7
_cod_original_cell_volume        298.62(6)
_cod_database_code               7228252
Synthesis, structures, and characterization of MMnZrF7 (M = Tl, Rb, NH4, K) fluorides : an example of 7-coordination of divalent manganese
Malika El-Ghozzi; Daniel Avignant; Maurice Guillot; Journal of Solid State Chemistry 108 (1994) 51–58; doi:10.1006/jssc.1994.1008

data_1545999
_publ_section_title
;
 Synthesis, structures, and characterization of MMnZrF7 (M = Tl, Rb, NH4,
 K) fluorides : an example of 7-coordination of divalent manganese
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              51
_journal_page_last               58
_journal_paper_doi               10.1006/jssc.1994.1008
_journal_volume                  108
_journal_year                    1994
_chemical_formula_sum            'F7 Mn Tl Zr'
_chemical_formula_weight         483.534
_space_group_IT_number           11
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 118.0(2)
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   6.450(1)
_cell_length_b                   8.250(1)
_cell_length_c                   6.459(2)
_cell_volume                     303.5(6)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    30.55
_exptl_crystal_density_diffrn    5.31
_exptl_crystal_F_000             418
_refine_ls_number_parameters     45
_refine_ls_number_reflns         562
_refine_ls_R_factor_gt           0.038
_refine_ls_wR_factor_gt          0.043
_cod_data_source_file            JSSC-1994-108-51-58-1.cif
_cod_data_source_block           TlMnZrF7
_cod_original_sg_symbol_H-M      'P 21/m'
_cod_database_code               1545999
Synthesis, structures, and characterization of MMnZrF7 (M = Tl, Rb, NH4, K) fluorides : an example of 7-coordination of divalent manganese
Malika El-Ghozzi; Daniel Avignant; Maurice Guillot; Journal of Solid State Chemistry 108 (1994) 51–58; doi:10.1006/jssc.1994.1008

data_1546000
_publ_section_title
;
 Synthesis, structures, and characterization of MMnZrF7 (M = Tl, Rb, NH4,
 K) fluorides : an example of 7-coordination of divalent manganese
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              51
_journal_page_last               58
_journal_paper_doi               10.1006/jssc.1994.1008
_journal_volume                  108
_journal_year                    1994
_chemical_formula_sum            'F7 Mn Rb Zr'
_chemical_formula_weight         364.619
_space_group_IT_number           11
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 117.9(2)
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   6.439(3)
_cell_length_b                   8.218(2)
_cell_length_c                   6.443(1)
_cell_volume                     301.3(6)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    11.59
_exptl_crystal_density_diffrn    4.02
_exptl_crystal_F_000             330
_refine_ls_number_parameters     33
_refine_ls_number_reflns         403
_refine_ls_R_factor_gt           0.064
_refine_ls_wR_factor_gt          0.074
_cod_data_source_file            JSSC-1994-108-51-58-2.cif
_cod_data_source_block           RbMnZrF7
_cod_original_sg_symbol_H-M      'P 21/m'
_cod_database_code               1546000