LMucko/crystallography-open-database huggingface dataset:
Hexagonal Na(1.5) Y(1.5) F6 at high pressures
Grzechnik, A.; Bouvier, P.; Mezouar, M.; Mathews, M.D.; Tyagi, A.K.; Koehler, J.; Journal of Solid State Chemistry 165 (2002) 159–164; doi:

data_1517673
_publ_section_title
;
 Hexagonal Na(1.5) Y(1.5) F6 at high pressures
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              159
_journal_page_last               164
_journal_volume                  165
_journal_year                    2002
_chemical_formula_structural     'Na Y (Na0.5 Y0.5) F6'
_chemical_formula_sum            'F6 Na1.5 Y1.5'
_chemical_name_systematic
;
Sodium Yttrium Fluoride (1.5/1.5/6)
;
_space_group_IT_number           174
_symmetry_Int_Tables_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            1
_cell_length_a                   5.6128(1)
_cell_length_b                   5.6128(1)
_cell_length_c                   3.3366(2)
_cell_volume                     91.032(6)
_cod_data_source_file            Na1_5Y1_5F6_P_6_DC254.cif
_cod_data_source_block           chateigner
_cod_original_cell_volume        91.03
_cod_database_code               1517673
Hexagonal Na(1.5) Y(1.5) F6 at high pressures
Grzechnik, A.; Bouvier, P.; Mezouar, M.; Mathews, M.D.; Tyagi, A.K.; Koehler, J.; Journal of Solid State Chemistry 165 (2002) 159–164; doi:

data_1517674
_publ_section_title
;
 Hexagonal Na(1.5) Y(1.5) F6 at high pressures
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              159
_journal_page_last               164
_journal_volume                  165
_journal_year                    2002
_chemical_formula_structural     '(Na1.5 Y0.5) Y F6'
_chemical_formula_sum            'F6 Na1.5 Y1.5'
_chemical_name_systematic
;
Sodium Yttrium Fluoride (1.5/1.5/6)
;
_space_group_IT_number           189
_symmetry_Int_Tables_number      189
_symmetry_space_group_name_Hall  'P -6 -2'
_symmetry_space_group_name_H-M   'P -6 2 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   5.6142(1)
_cell_length_b                   5.6142(1)
_cell_length_c                   3.3367(1)
_cell_volume                     91.080(4)
_cod_data_source_file            Na1_5Y1_5F6_P_62m_DC255.cif
_cod_data_source_block           chateigner
_cod_original_cell_volume        91.08
_cod_database_code               1517674
Hexagonal Na(1.5) Y(1.5) F6 at high pressures
Grzechnik, A.; Bouvier, P.; Mezouar, M.; Mathews, M.D.; Tyagi, A.K.; Koehler, J.; Journal of Solid State Chemistry 165 (2002) 159–164; doi:

data_1517675
_publ_section_title
;
 Hexagonal Na(1.5) Y(1.5) F6 at high pressures
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              159
_journal_page_last               164
_journal_volume                  165
_journal_year                    2002
_chemical_formula_structural     'Na (Na0.5 Y1.5) F6'
_chemical_formula_sum            'F6 Na1.5 Y1.5'
_chemical_name_systematic
;
Sodium Yttrium Fluoride (1.5/1.5/6)
;
_space_group_IT_number           176
_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            1
_cell_length_a                   5.6022(2)
_cell_length_b                   5.6022(2)
_cell_length_c                   3.3295(2)
_cell_volume                     90.495(7)
_cod_data_source_file            Na1_5Y1_5F6_P63_m_DC256
_cod_data_source_block           chateigner
_cod_original_cell_volume        90.5
_cod_database_code               1517675
Controlled massively defective crystalline solutions with the fluorite structure
Roy, D.M.; Roy, R.; Journal of the Electrochemical Society 111 (1964) 421–429; doi:

data_1517676
_publ_section_title
;
 Controlled massively defective crystalline solutions with the fluorite
 structure
;
_journal_name_full               'Journal of the Electrochemical Society'
_journal_page_first              421
_journal_page_last               429
_journal_volume                  111
_journal_year                    1964
_chemical_formula_structural     'Na Y F4'
_chemical_formula_sum            'F4 Na Y'
_chemical_name_systematic        'Sodium Yttrium Fluoride - Ht'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   5.47
_cell_length_b                   5.47
_cell_length_c                   5.47
_cell_volume                     163.667
_cod_data_source_file            NaYF4_Fm_3m_DC258.cif
_cod_data_source_block           chateigner
_cod_original_cell_volume        163.67
_cod_original_formula_sum        'F4 Na1 Y1'
_cod_database_code               1517676
Defect structure of Na0.39 Y0.61 F2.22 crystals
Zhurova, E.A.; Maksimov, B.A.; Hull, S.; Wilson, S.S.; Sobolev, B.P.; Simonov, V.I.; Kristallografiya 42 (1997) 277–282; doi:

data_1517677
_publ_section_title
;
 Defect structure of Na0.39 Y0.61 F2.22 crystals
;
_journal_name_full               Kristallografiya
_journal_page_first              277
_journal_page_last               282
_journal_volume                  42
_journal_year                    1997
_chemical_formula_analytical     '(Na0.39 Y0.61) F2.22'
_chemical_formula_structural     '(Na0.39 Y0.61) F2.35'
_chemical_formula_sum            'F2.35 Na0.39 Y0.61'
_chemical_name_systematic
;
Sodium Yttrium Fluoride (0.38/0.61/2.35)
;
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   5.506
_cell_length_b                   5.506
_cell_length_c                   5.506
_cell_volume                     166.920
_cod_data_source_file            NaYF4_Fm_3m_DC259.cif
_cod_data_source_block           chateigner
_cod_original_cell_volume        166.92
_cod_database_code               1517677
Defect structure of Na0.39 Y0.61 F2.22 crystals
Zhurova, E.A.; Maksimov, B.A.; Hull, S.; Wilson, S.S.; Sobolev, B.P.; Simonov, V.I.; Kristallografiya 42 (1997) 277–282; doi:

data_1517678
_publ_section_title
;
 Defect structure of Na0.39 Y0.61 F2.22 crystals
;
_journal_name_full               Kristallografiya
_journal_page_first              277
_journal_page_last               282
_journal_volume                  42
_journal_year                    1997
_chemical_formula_structural     '(Na0.39 Y0.61) F2.22'
_chemical_formula_sum            'F2.22 Na0.39 Y0.61'
_chemical_name_systematic
;
Sodium Yttrium Fluoride (0.38/0.61/2.22)
;
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   5.5067(4)
_cell_length_b                   5.5067
_cell_length_c                   5.5067
_cell_volume                     166.984(12)
_cod_data_source_file            Na0_39Y0_61F2_22_Fm_3m_DC260.cif
_cod_data_source_block           chateigner
_cod_original_cell_volume        166.98
_cod_database_code               1517678
The crystal structures of yttrium fluoride and related compounds
Zalkin, A.; Templeton, D.H.; Journal of the American Chemical Society 75 (1953) 2453–2458; doi:

data_4122597
_publ_section_title
;
 The crystal structures of yttrium fluoride and related compounds
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2453
_journal_page_last               2458
_journal_volume                  75
_journal_year                    1953
_chemical_formula_structural     'Na (Y3 F10)'
_chemical_formula_sum            'F10 Na Y3'
_chemical_name_systematic        'Sodium Triyttrium Fluoride'
_space_group_IT_number           221
_symmetry_Int_Tables_number      221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            1
_cell_length_a                   5.675
_cell_length_b                   5.675
_cell_length_c                   5.675
_cell_volume                     182.767
_cod_data_source_file            NaY3F10_Pm_3m_DC261.cif
_cod_data_source_block           chateigner_
_cod_original_cell_volume        182.77
_cod_original_formula_sum        'F10 Na1 Y3'
_cod_database_code               4122597
Crystal Structure, Electronic Structure, and Temperature-Dependent Raman Spectra of Tl[Ag(CN)2]: Evidence for Ligand-Unsupported Argentophilic Interactions
Omary, Mohammad A.; Webb, Thomas R.; Assefa, Zerihun; Shankle, George E.; Patterson, Howard H.; Inorganic Chemistry 37 (1998) 1380–1386; doi:10.1021/ic970694l

data_4341102
_publ_section_title
;
 Crystal Structure, Electronic Structure, and Temperature-Dependent Raman
 Spectra of Tl[Ag(CN)2]: Evidence for Ligand-Unsupported Argentophilic
 Interactions
;
_journal_issue                   6
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1380
_journal_page_last               1386
_journal_paper_doi               10.1021/ic970694l
_journal_volume                  37
_journal_year                    1998
_chemical_formula_structural     'C2 Ag N2 Tl'
_chemical_formula_sum            'C2 Ag N2 Tl'
_chemical_name_systematic        'Thallium dicyanoargentate(I)'
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_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                 91.66(2)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.798(1)
_cell_length_b                   14.685(3)
_cell_length_c                   8.566(2)
_cell_volume                     980.5(3)
_refine_ls_R_factor_all          0.0643
_refine_ls_wR_factor_all         0.0899
_cod_data_source_file            TlAgCN2.cif
_cod_data_source_block           thorium
_cod_database_code               4341102
Blue-shift of Eu(2+) emission in (Ba,Sr)3Lu(PO4)3:Eu(2+) eulytite solid-solution phosphors resulting from release of neighbouring-cation-induced stress.
Wang, Ziyuan; Xia, Zhiguo; Molokeev, Maxim S.; Atuchin, Victor V.; Liu, QuanLin; Dalton transactions (Cambridge, England : 2003) 43 (2014) 16800–16804; doi:10.1039/c4dt02319f

data_7032534
_publ_section_title
;
 Blue-shift of Eu(2+) emission in (Ba,Sr)3Lu(PO4)3:Eu(2+) eulytite
 solid-solution phosphors resulting from release of
 neighbouring-cation-induced stress.
;
_journal_issue                   44
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              16800
_journal_page_last               16804
_journal_paper_doi               10.1039/c4dt02319f
_journal_volume                  43
_journal_year                    2014
_chemical_formula_moiety
'Eu0.13 O48 P12, 16(Lu0.25), 3.97(Ba), 7.92(Sr)'
_chemical_formula_sum            'Ba3.97 Eu0.13 Lu4 O48 P12 Sr7.92'
_chemical_formula_weight         3097.85
_space_group_IT_number           220
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'I -4bd 2c 3'
_symmetry_space_group_name_H-M   'I -4 3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   10.221468(67)
_cell_length_b                   10.221468(67)
_cell_length_c                   10.221468(67)
_cell_measurement_temperature    300
_cell_volume                     1067.923(12)
_diffrn_ambient_temperature      300
_diffrn_measurement_device_type
;
D8 ADVANCE Bruker
;
_diffrn_radiation_monochromator  none
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type
;
 Cu K\a~1~~2~
;
_exptl_absorpt_coefficient_mu    64.004
_exptl_crystal_density_diffrn    4.813306
_pd_char_colour
;
colourless
;
_pd_meas_2theta_range_inc        0.02228
_pd_meas_2theta_range_max        120.011642
_pd_meas_2theta_range_min        5.0020266
_pd_meas_scan_method             step
_pd_proc_ls_pref_orient_corr
;
no correction
;
_pd_proc_ls_profile_function     PearsonVII
_pd_proc_ls_prof_R_factor        3.947
_pd_proc_ls_prof_wR_expected     2.807
_pd_proc_ls_prof_wR_factor       5.073
_pd_proc_number_of_points        5162.01146
_pd_spec_mount_mode              reflection
_refine_ls_goodness_of_fit_all   1.807
_refine_ls_R_I_factor            1.46
_refine_ls_shift/su_max          0.01000
_cod_data_source_file            c4dt02319f1.cif
_cod_data_source_block           a
_cod_depositor_comments
'Adding full bibliography for 7032534--7032537.cif.'
_cod_original_cell_volume        1067.923(21)
_cod_original_sg_symbol_Hall
;
I -4bd 2c 3
;
_cod_original_sg_symbol_H-M      I-43d
_cod_original_formula_sum
;
Ba3.97 Eu0.13 Lu4 O48 P12 Sr7.92
;
_cod_database_code               7032534
Blue-shift of Eu(2+) emission in (Ba,Sr)3Lu(PO4)3:Eu(2+) eulytite solid-solution phosphors resulting from release of neighbouring-cation-induced stress.
Wang, Ziyuan; Xia, Zhiguo; Molokeev, Maxim S.; Atuchin, Victor V.; Liu, QuanLin; Dalton transactions (Cambridge, England : 2003) 43 (2014) 16800–16804; doi:10.1039/c4dt02319f

data_7032535
_publ_section_title
;
 Blue-shift of Eu(2+) emission in (Ba,Sr)3Lu(PO4)3:Eu(2+) eulytite
 solid-solution phosphors resulting from release of
 neighbouring-cation-induced stress.
;
_journal_issue                   44
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              16800
_journal_page_last               16804
_journal_paper_doi               10.1039/c4dt02319f
_journal_volume                  43
_journal_year                    2014
_chemical_formula_moiety         '3(O4 P), 2.97(Ba), Lu, 0.03(Eu)'
_chemical_formula_sum            'Ba2.97 Eu0.03 Lu O12 P3'
_chemical_formula_weight         872.89
_space_group_IT_number           220
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'I -4bd 2c 3'
_symmetry_space_group_name_H-M   'I -4 3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.460404(81)
_cell_length_b                   10.460404(81)
_cell_length_c                   10.460404(81)
_cell_measurement_temperature    300
_cell_volume                     1144.578(15)
_diffrn_ambient_temperature      300
_diffrn_measurement_device_type
;
D8 ADVANCE Bruker
;
_diffrn_radiation_monochromator  none
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type
;
 Cu K\a~1~~2~
;
_exptl_absorpt_coefficient_mu    100.197
_exptl_crystal_density_diffrn    5.065
_pd_char_colour
;
colourless
;
_pd_meas_2theta_range_inc        0.02228
_pd_meas_2theta_range_max        120.011642
_pd_meas_2theta_range_min        5.0020266
_pd_meas_scan_method             step
_pd_proc_ls_pref_orient_corr
;
no correction
;
_pd_proc_ls_profile_function     PearsonVII
_pd_proc_ls_prof_R_factor        4.477
_pd_proc_ls_prof_wR_expected     3.551
_pd_proc_ls_prof_wR_factor       5.730
_pd_proc_number_of_points        5162.01146
_pd_spec_mount_mode              reflection
_refine_ls_goodness_of_fit_all   1.614
_refine_ls_R_I_factor            1.47
_refine_ls_shift/su_max          0.01000
_cod_data_source_file            c4dt02319f3.cif
_cod_data_source_block           a
_cod_depositor_comments
'Adding full bibliography for 7032534--7032537.cif.'
_cod_original_cell_volume        1144.578(27)
_cod_original_sg_symbol_Hall
;
I -4bd 2c 3
;
_cod_original_sg_symbol_H-M      I-43d
_cod_original_formula_sum
;
Ba2.97 Eu0.03 Lu O12 P3
;
_cod_database_code               7032535
Blue-shift of Eu(2+) emission in (Ba,Sr)3Lu(PO4)3:Eu(2+) eulytite solid-solution phosphors resulting from release of neighbouring-cation-induced stress.
Wang, Ziyuan; Xia, Zhiguo; Molokeev, Maxim S.; Atuchin, Victor V.; Liu, QuanLin; Dalton transactions (Cambridge, England : 2003) 43 (2014) 16800–16804; doi:10.1039/c4dt02319f

data_7032536
_publ_section_title
;
 Blue-shift of Eu(2+) emission in (Ba,Sr)3Lu(PO4)3:Eu(2+) eulytite
 solid-solution phosphors resulting from release of
 neighbouring-cation-induced stress.
;
_journal_issue                   44
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              16800
_journal_page_last               16804
_journal_paper_doi               10.1039/c4dt02319f
_journal_volume                  43
_journal_year                    2014
_chemical_formula_moiety
'Eu0.13 O48 P12, 16(Lu0.25), 7.92(Ba), 3.97(Sr)'
_chemical_formula_sum            'Ba7.92 Eu0.13 Lu4 O48 P12 Sr3.97'
_chemical_formula_weight         3294.30
_space_group_IT_number           220
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'I -4bd 2c 3'
_symmetry_space_group_name_H-M   'I -4 3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   10.34543(16)
_cell_length_b                   10.34543(16)
_cell_length_c                   10.34543(16)
_cell_measurement_temperature    300
_cell_volume                     1107.25(3)
_diffrn_ambient_temperature      300
_diffrn_measurement_device_type
;
D8 ADVANCE Bruker
;
_diffrn_radiation_monochromator  none
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type
;
 Cu K\a~1~~2~
;
_exptl_absorpt_coefficient_mu    82.610
_exptl_crystal_density_diffrn    4.937535
_pd_char_colour
;
colourless
;
_pd_meas_2theta_range_inc        0.02228
_pd_meas_2theta_range_max        120.011642
_pd_meas_2theta_range_min        5.0020266
_pd_meas_scan_method             step
_pd_proc_ls_pref_orient_corr
;
no correction
;
_pd_proc_ls_profile_function     PearsonVII
_pd_proc_ls_prof_R_factor        4.514
_pd_proc_ls_prof_wR_expected     3.171
_pd_proc_ls_prof_wR_factor       6.357
_pd_proc_number_of_points        5162.01146
_pd_spec_mount_mode              reflection
_refine_ls_goodness_of_fit_all   2.004
_refine_ls_R_I_factor            1.70
_refine_ls_shift/su_max          0.01000
_cod_data_source_file            c4dt02319f2.cif
_cod_data_source_block           a
_cod_depositor_comments
'Adding full bibliography for 7032534--7032537.cif.'
_cod_original_cell_volume        1107.250(51)
_cod_original_sg_symbol_Hall
;
I -4bd 2c 3
;
_cod_original_sg_symbol_H-M      I-43d
_cod_original_formula_sum
;
Ba7.92 Eu0.13 Lu4 O48 P12 Sr3.97
;
_cod_database_code               7032536
Blue-shift of Eu(2+) emission in (Ba,Sr)3Lu(PO4)3:Eu(2+) eulytite solid-solution phosphors resulting from release of neighbouring-cation-induced stress.
Wang, Ziyuan; Xia, Zhiguo; Molokeev, Maxim S.; Atuchin, Victor V.; Liu, QuanLin; Dalton transactions (Cambridge, England : 2003) 43 (2014) 16800–16804; doi:10.1039/c4dt02319f

data_7032537
_publ_section_title
;
 Blue-shift of Eu(2+) emission in (Ba,Sr)3Lu(PO4)3:Eu(2+) eulytite
 solid-solution phosphors resulting from release of
 neighbouring-cation-induced stress.
;
_journal_issue                   44
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              16800
_journal_page_last               16804
_journal_paper_doi               10.1039/c4dt02319f
_journal_volume                  43
_journal_year                    2014
_chemical_formula_moiety         'Eu0.13 O48 P12, 16(Lu0.25), 11.89(Sr)'
_chemical_formula_sum            'Eu0.13 Lu4 O48 P12 Sr11.89'
_chemical_formula_weight         2900.60
_space_group_IT_number           220
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'I -4bd 2c 3'
_symmetry_space_group_name_H-M   'I -4 3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   10.090197(60)
_cell_length_b                   10.090197(60)
_cell_length_c                   10.090197(60)
_cell_measurement_temperature    300
_cell_volume                     1027.304(11)
_diffrn_ambient_temperature      300
_diffrn_measurement_device_type
;
D8 ADVANCE Bruker
;
_diffrn_radiation_monochromator  none
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type
;
 Cu K\a~1~~2~
;
_exptl_absorpt_coefficient_mu    43.939
_exptl_crystal_density_diffrn    4.685457
_pd_char_colour
;
colourless
;
_pd_meas_2theta_range_inc        0.02228
_pd_meas_2theta_range_max        120.011642
_pd_meas_2theta_range_min        5.0020266
_pd_meas_scan_method             step
_pd_proc_ls_pref_orient_corr
;
no correction
;
_pd_proc_ls_profile_function     PearsonVII
_pd_proc_ls_prof_R_factor        3.589
_pd_proc_ls_prof_wR_expected     2.402
_pd_proc_ls_prof_wR_factor       4.671
_pd_proc_number_of_points        5162.01146
_pd_spec_mount_mode              reflection
_refine_ls_goodness_of_fit_all   1.945
_refine_ls_R_I_factor            1.69
_refine_ls_shift/su_max          0.01000
_cod_data_source_file            c4dt02319f5.cif
_cod_data_source_block           a
_cod_depositor_comments
'Adding full bibliography for 7032534--7032537.cif.'
_cod_original_cell_volume        1027.304(18)
_cod_original_sg_symbol_Hall
;
I -4bd 2c 3
;
_cod_original_sg_symbol_H-M      I-43d
_cod_original_formula_sum
;
Eu0.13 Lu4 O48 P12 Sr11.89
;
_cod_database_code               7032537
The crystal structure of β-NbPO~5~
Leclaire, A.; Chahboun, H.; Groult, D.; Raveau, B.; Zeitschrift für Kristallographie 177 (1986) 277–286; doi:10.1524/zkri.1986.177.3-4.277

data_8103499
_publ_section_title
;
 The crystal structure of \b-NbPO~5~
;
_journal_name_full               'Zeitschrift f\"ur Kristallographie'
_journal_page_first              277
_journal_page_last               286
_journal_paper_doi               10.1524/zkri.1986.177.3-4.277
_journal_volume                  177
_journal_year                    1986
_chemical_formula_structural     'Nb O (P O4)'
_chemical_formula_sum            'Nb O5 P'
_chemical_name_systematic        'Niobium Oxide Phosphate(V) - Beta'
_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                 120.334(8)
_cell_angle_gamma                90.
_cell_formula_units_Z            8
_cell_length_a                   13.0969(16)
_cell_length_b                   5.2799(6)
_cell_length_c                   13.2281(16)
_cell_volume                     789.50(18)
_cod_data_source_file            NbPO5_P_21_c_DC253.cif
_cod_data_source_block           chateigner
_cod_original_cell_volume        789.5
_cod_original_formula_sum        'Nb1 O5 P1'
_cod_database_code               8103499