LMucko/crystallography-open-database huggingface dataset:
Structure of Cs~3~(HSO~4~)~2~(H~2~PO~4~) – a new compound with a superprotonic phase transition
Haile, S. M.; Kreuer, K.-D.; Maier, J.; Acta Crystallographica Section B 51 (1995) 680–687; doi:10.1107/S0108768195005684

data_2101351
_publ_section_title
;
 Structure of Cs~3~(HSO~4~)~2~(H~2~PO~4~) -- a new compound with a
 superprotonic phase transition
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              680
_journal_page_last               687
_journal_paper_doi               10.1107/S0108768195005684
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'Cs3 H4 O12 P S2'
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.0
_cell_angle_beta                 100.536(14)
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   19.546(3)
_cell_length_b                   7.8798(10)
_cell_length_c                   9.1854(17)
_cell_volume                     1390.9(4)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.7788
_exptl_crystal_density_diffrn    3.295
_cod_data_source_file            du0399.cif
_cod_data_source_block           du0399a
_cod_original_cell_volume        1390.7(4)
_cod_original_formula_sum        'H4 Cs3 O12 P1 S2'
_cod_database_code               2101351
Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length
Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G.; Acta Crystallographica Section B 51 (1995) 823–835; doi:10.1107/S0108768194013054

data_2101352
_publ_section_title
;
 Molecular conformations and crystal packing properties of five
 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a
 surprising dependence upon alkyl chain length
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              823
_journal_page_last               835
_journal_paper_doi               10.1107/S0108768194013054
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C16 H22 N2'
_chemical_formula_weight         242.40
_space_group_crystal_system      monoclinic
_space_group_IT_number           4
_space_group_name_Hall           'P 2yb'
_space_group_name_H-M_alt        'P 1 21 1'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.43(3)
_cell_angle_gamma                90.0
_cell_formula_units_Z            8
_cell_length_a                   8.317(2)
_cell_length_b                   17.435(3)
_cell_length_c                   20.011(4)
_cell_volume                     2901.7(10)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.065
_exptl_crystal_density_diffrn    1.110
_exptl_crystal_F_000             1056
_cod_data_source_file            gr0375.cif
_cod_data_source_block           gr0375a
_cod_depositor_comments
;
 Marking atoms 'C(16A)', 'C(18A)', 'H(16A)', 'H(16B)', 'H(18A)', 'H(18B)',
 'H(18C)' and 'C(16W)', 'C(18W)' as belonging to disorder sites '1' and '2'
 with the occupancies of 0.86(2) and 0.14(2) respectively after consulting
 the original publication.

 Antanas Vaitkus,
 2018-02-05
;
_cod_database_code               2101352
Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length
Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G.; Acta Crystallographica Section B 51 (1995) 823–835; doi:10.1107/S0108768194013054

data_2101353
_publ_section_title
;
 Molecular conformations and crystal packing properties of five
 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a
 surprising dependence upon alkyl chain length
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              823
_journal_page_last               835
_journal_paper_doi               10.1107/S0108768194013054
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C17 H24 N2'
_chemical_formula_weight         256.43
_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                90.0
_cell_angle_beta                 97.10(3)
_cell_angle_gamma                90.0
_cell_formula_units_Z            8
_cell_length_a                   9.065(2)
_cell_length_b                   9.750(2)
_cell_length_c                   35.191(7)
_cell_volume                     3086.5(11)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.060
_exptl_crystal_density_diffrn    1.103
_exptl_crystal_F_000             1120
_cod_data_source_file            gr0375.cif
_cod_data_source_block           gr0375b
_cod_database_code               2101353
Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length
Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G.; Acta Crystallographica Section B 51 (1995) 823–835; doi:10.1107/S0108768194013054

data_2101354
_publ_section_title
;
 Molecular conformations and crystal packing properties of five
 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a
 surprising dependence upon alkyl chain length
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              823
_journal_page_last               835
_journal_paper_doi               10.1107/S0108768194013054
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C18 H26 N2'
_chemical_formula_weight         270.41
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                106.69(2)
_cell_angle_beta                 93.69(3)
_cell_angle_gamma                93.33(3)
_cell_formula_units_Z            2
_cell_length_a                   6.369(3)
_cell_length_b                   9.071(3)
_cell_length_c                   14.682(4)
_cell_volume                     808.2(5)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.065
_exptl_crystal_density_diffrn    1.111
_exptl_crystal_F_000             296
_cod_data_source_file            gr0375.cif
_cod_data_source_block           gr0375c
_cod_database_code               2101354
Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length
Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G.; Acta Crystallographica Section B 51 (1995) 823–835; doi:10.1107/S0108768194013054

data_2101355
_publ_section_title
;
 Molecular conformations and crystal packing properties of five
 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a
 surprising dependence upon alkyl chain length
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              823
_journal_page_last               835
_journal_paper_doi               10.1107/S0108768194013054
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C19 H28 N2'
_chemical_formula_weight         284.49
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                106.060(10)
_cell_angle_beta                 101.270(10)
_cell_angle_gamma                100.130(10)
_cell_formula_units_Z            8
_cell_length_a                   11.0610(10)
_cell_length_b                   15.690(3)
_cell_length_c                   21.641(3)
_cell_volume                     3432.6(9)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.060
_exptl_crystal_density_diffrn    1.101
_exptl_crystal_F_000             1248
_cod_data_source_file            gr0375.cif
_cod_data_source_block           gr0375d
_cod_database_code               2101355
Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length
Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G.; Acta Crystallographica Section B 51 (1995) 823–835; doi:10.1107/S0108768194013054

data_2101356
_publ_section_title
;
 Molecular conformations and crystal packing properties of five
 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a
 surprising dependence upon alkyl chain length
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              823
_journal_page_last               835
_journal_paper_doi               10.1107/S0108768194013054
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C20 H30 N2'
_chemical_formula_weight         298.52
_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                90.0
_cell_angle_beta                 102.74(3)
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   12.331(2)
_cell_length_b                   11.086(2)
_cell_length_c                   13.929(3)
_cell_volume                     1857.2(6)
_diffrn_radiation_type           Cu
_diffrn_radiation_wavelength     1.54184
_exptl_absorpt_coefficient_mu    0.438
_exptl_crystal_density_diffrn    1.067
_exptl_crystal_F_000             656
_cod_data_source_file            gr0375.cif
_cod_data_source_block           gr0375e
_cod_database_code               2101356
Structure at 140 K, lattice dynamics and phase transition of 4,4'-dichlorobenzophenone
Zúñiga, F. J.; Criado, A.; Acta Crystallographica Section B 51 (1995) 880–888; doi:10.1107/S0108768194014321

data_2101357
_publ_section_title
;
 Structure at 140 K, lattice dynamics and phase transition of
 4,4'-dichlorobenzophenone
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              880
_journal_page_last               888
_journal_paper_doi               10.1107/S0108768194014321
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C13 H8 Cl2 O'
_chemical_formula_weight         251.1
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-I 2yc'
_symmetry_space_group_name_H-M   'I 1 2/c 1'
_cell_angle_alpha                90.0
_cell_angle_beta                 100.14(3)
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   24.620(10)
_cell_length_b                   6.0910(10)
_cell_length_c                   7.476(2)
_cell_volume                     1103.6(6)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.55
_exptl_crystal_density_diffrn    1.510
_exptl_crystal_F_000             512
_cod_data_source_file            hr0007.cif
_cod_data_source_block           hr0007a
_cod_original_cell_volume        1104(2)
_cod_original_formula_sum        'C13 H8 Cl2 O1'
_cod_database_code               2101357
Structure, solid-state photochemistry and reactivity in asymmetric synthesis of 3,4-bis(diphenylmethylene)-<i>N</i>-methylsuccinimide
Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.; Acta Crystallographica Section B 51 (1995) 856–863; doi:10.1107/S0108768194014540

data_2101358
_publ_section_title
;
 Structure, solid-state photochemistry and reactivity in asymmetric
 synthesis of 3,4-bis(diphenylmethylene)-<i>N</i>-methylsuccinimide
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              856
_journal_page_last               863
_journal_paper_doi               10.1107/S0108768194014540
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C31 H23 N O2'
_chemical_formula_weight         441.53
_space_group_crystal_system      monoclinic
_space_group_IT_number           4
_space_group_name_Hall           'P 2yb'
_space_group_name_H-M_alt        'P 1 21 1'
_cell_angle_alpha                90.0
_cell_angle_beta                 114.830(10)
_cell_angle_gamma                90.0
_cell_formula_units_Z            2
_cell_length_a                   11.640(3)
_cell_length_b                   9.257(2)
_cell_length_c                   12.103(4)
_cell_volume                     1183.6(6)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.072
_exptl_crystal_density_diffrn    1.239
_exptl_crystal_F_000             464
_cod_data_source_file            hr0011.cif
_cod_data_source_block           hr0011a
_cod_original_formula_sum        'C31 H23 N1 O2'
_cod_database_code               2101358
Structure, solid-state photochemistry and reactivity in asymmetric synthesis of 3,4-bis(diphenylmethylene)-<i>N</i>-methylsuccinimide
Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.; Acta Crystallographica Section B 51 (1995) 856–863; doi:10.1107/S0108768194014540

data_2101359
_publ_section_title
;
 Structure, solid-state photochemistry and reactivity in asymmetric
 synthesis of 3,4-bis(diphenylmethylene)-<i>N</i>-methylsuccinimide
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              856
_journal_page_last               863
_journal_paper_doi               10.1107/S0108768194014540
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C31 H23 N O2'
_chemical_formula_weight         441.53
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2n 2ab'
_symmetry_space_group_name_H-M   'P b c n'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   9.9640(10)
_cell_length_b                   20.181(3)
_cell_length_c                   11.622(3)
_cell_volume                     2337.0(7)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.073
_exptl_crystal_density_diffrn    1.255
_exptl_crystal_F_000             928
_cod_data_source_file            hr0011.cif
_cod_data_source_block           hr0011b
_cod_original_formula_sum        'C31 H23 N1 O2'
_cod_database_code               2101359
Structure, solid-state photochemistry and reactivity in asymmetric synthesis of 3,4-bis(diphenylmethylene)-<i>N</i>-methylsuccinimide
Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I.; Acta Crystallographica Section B 51 (1995) 856–863; doi:10.1107/S0108768194014540

data_2101360
_publ_section_title
;
 Structure, solid-state photochemistry and reactivity in asymmetric
 synthesis of 3,4-bis(diphenylmethylene)-<i>N</i>-methylsuccinimide
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              856
_journal_page_last               863
_journal_paper_doi               10.1107/S0108768194014540
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C31 H23 N O2'
_chemical_formula_weight         441.53
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.0
_cell_angle_beta                 98.62(2)
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   9.485(3)
_cell_length_b                   11.014(2)
_cell_length_c                   22.945(3)
_cell_volume                     2369.9(9)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.072
_exptl_crystal_density_diffrn    1.238
_exptl_crystal_F_000             928
_cod_data_source_file            hr0011.cif
_cod_data_source_block           hr0011c
_cod_original_formula_sum        'C31 H23 N1 O2'
_cod_database_code               2101360
High-pressure X-ray diffraction study of pentaerythritol
Katrusiak, A.; Acta Crystallographica Section B 51 (1995) 873–879; doi:10.1107/S010876819500098X

data_2101361
_publ_section_title
;
 High-pressure X-ray diffraction study of pentaerythritol
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              873
_journal_page_last               879
_journal_paper_doi               10.1107/S010876819500098X
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C5 H12 O4'
_chemical_formula_weight         136.15
_symmetry_cell_setting           tetragonal
_symmetry_space_group_name_Hall  'I -4'
_symmetry_space_group_name_H-M   'I -4'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            2
_cell_length_a                   6.0173(10)
_cell_length_b                   6.0173(10)
_cell_length_c                   8.267(3)
_cell_volume                     299.33(13)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    0.084
_exptl_crystal_density_diffrn    1.511
_exptl_crystal_F_000             148
_cod_data_source_file            hr0019.cif
_cod_data_source_block           hr0019a
_cod_original_cell_volume        299.3(2)
_cod_database_code               2101361
Determination of the incommensurately modulated structure of (perylene)Co(mnt)~2~(CH~2~Cl~2~)~0.5~ by direct methods
Lam, E. J. W.; Beurskens, P. T.; Smits, J. M. M.; van Smaalen, S.; de Boer, J. L.; Fan, H.-F.; Acta Crystallographica Section B 51 (1995) 779–789; doi:10.1107/S0108768194014345

data_2101362
_publ_section_title
;
 Determination of the incommensurately modulated structure of
 (perylene)Co(mnt)~2~(CH~2~Cl~2~)~0.5~ by direct methods
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              779
_journal_page_last               789
_journal_paper_doi               10.1107/S0108768194014345
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'C28.5 H13 Cl Co N4 S4'
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                92.092(11)
_cell_angle_beta                 95.343(16)
_cell_angle_gamma                94.67(2)
_cell_formula_units_Z            2
_cell_length_a                   6.5441(13)
_cell_length_b                   11.7173(15)
_cell_length_c                   16.4251(17)
_cell_volume                     1248.6(3)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    1.1429
_exptl_crystal_density_diffrn    1.687
_cod_data_source_file            js0010.cif
_cod_data_source_block           js0010a
_cod_original_formula_sum        'C28.5 H13 Cl1 Co1 N4 S4'
_cod_database_code               2101362
Single-crystal pulsed neutron diffraction of a highly hydrous beryl
Artioli, G.; Rinaldi, R.; Wilson, C. C.; Zanazzi, P. F.; Acta Crystallographica Section B 51 (1995) 733–737; doi:10.1107/S0108768194014631

data_2101363
_publ_section_title
;
 Single-crystal pulsed neutron diffraction of a highly hydrous beryl
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              733
_journal_page_last               737
_journal_paper_doi               10.1107/S0108768194014631
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'Al2 Be3 H2 Na O19 Si6'
_chemical_formula_weight         578.51
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  '-P 6 2c'
_symmetry_space_group_name_H-M   'P 6/m c c'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                120.0
_cell_formula_units_Z            2
_cell_length_a                   9.278(2)
_cell_length_b                   9.278(2)
_cell_length_c                   9.195(2)
_cell_volume                     685.5(3)
_diffrn_ambient_temperature      100
_diffrn_radiation_probe          neutron
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_cod_data_source_file            na0059.cif
_cod_data_source_block           na0059a
_cod_original_formula_sum        'H2 Al2 Be3 Na1 O19 Si6'
_cod_structure_determination_method 'powder diffraction'
_cod_database_code               2101363
Site preference of cations and structural variation in Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) solid solutions with garnet structure
Nakatsuka, A.; Yoshiasa, A.; Takeno, S.; Acta Crystallographica Section B 51 (1995) 737–745; doi:10.1107/S0108768194014813

data_2101364
_publ_section_title
;
 Site preference of cations and structural variation in
 Y~3~Fe~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {\/leq} <i>x</i> {\/leq} 5)
 solid solutions with garnet structure
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              737
_journal_page_last               745
_journal_paper_doi               10.1107/S0108768194014813
_journal_volume                  51
_journal_year                    1995
_chemical_formula_sum            'Fe5 O12 Y3'
_chemical_formula_weight         737.94
_space_group_crystal_system      cubic
_space_group_IT_number           230
_space_group_name_Hall           '-I 4bd 2c 3'
_space_group_name_H-M_alt        'I a -3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.3750(10)
_cell_length_b                   12.3750(10)
_cell_length_c                   12.3750(10)
_cell_volume                     1895.1(3)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    26.42
_exptl_crystal_density_diffrn    5.17
_exptl_crystal_F_000             2744
_cod_data_source_file            oh0041.cif
_cod_data_source_block           oh0041a
_cod_original_cell_volume        1895.3(3)
_cod_database_code               2101364