LMucko/crystallography-open-database huggingface dataset:
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051258z

data_4300420
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051258z
_journal_year                    2006
_chemical_formula_moiety         'C6 H10 Mn N8 O'
_chemical_formula_sum            'C6 H10 Mn N8 O'
_chemical_formula_weight         265.16
_chemical_name_common            '[Mn(N3)2(2,6-dimethylpyz)(H2O)]n'
_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                90.00
_cell_angle_beta                 94.53(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.513(4)
_cell_length_b                   17.438(7)
_cell_length_c                   8.404(4)
_cell_measurement_temperature    99(2)
_cell_volume                     1097.6(9)
_diffrn_ambient_temperature      99(2)
_exptl_crystal_density_diffrn    1.605
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4300420
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051258z

data_4300421
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051258z
_journal_year                    2006
_chemical_formula_moiety         'C8 H6 Cl2 Mn N10'
_chemical_formula_sum            'C8 H6 Cl2 Mn N10'
_chemical_formula_weight         368.07
_chemical_name_common            '[Mn(N3)2(chloro-pyrazine)2]n'
_space_group_IT_number           61
_space_group_name_Hall           '-P 2ac 2ab'
_space_group_name_H-M_alt        'P b c a'
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   8.600(2)
_cell_length_b                   13.440(4)
_cell_length_c                   24.083(7)
_cell_measurement_temperature    99(2)
_cell_volume                     2783.6(13)
_diffrn_ambient_temperature      99(2)
_exptl_crystal_density_diffrn    1.757
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300421
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051258z

data_4300422
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051258z
_journal_year                    2006
_chemical_formula_moiety         'H4 Mn N6 O2, C6 H8 N2'
_chemical_formula_sum            'C6 H12 Mn N8 O2'
_chemical_formula_weight         283.18
_chemical_name_common            '[Mn(N3)2(H2O)2](2,3-Dimethylpyrazine)'
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 93.76(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   20.438(7)
_cell_length_b                   7.711(2)
_cell_length_c                   7.457(2)
_cell_measurement_temperature    99(2)
_cell_volume                     1172.7(6)
_diffrn_ambient_temperature      99(2)
_exptl_crystal_density_diffrn    1.604
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4300422
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051258z

data_4300423
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051258z
_journal_year                    2006
_chemical_formula_moiety         'C6 H10 Mn N8 O'
_chemical_formula_sum            'C6 H10 Mn N8 O'
_chemical_formula_weight         265.16
_chemical_name_common            '[Mn(N3)2(Ethylpyrazine)(H2O)]n'
_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                71.82(2)
_cell_angle_beta                 72.08(2)
_cell_angle_gamma                88.54(2)
_cell_formula_units_Z            2
_cell_length_a                   7.386(2)
_cell_length_b                   8.434(2)
_cell_length_c                   9.442(3)
_cell_measurement_temperature    100(2)
_cell_volume                     530.1(3)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.661
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300423
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051258z

data_4300424
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051258z
_journal_year                    2006
_chemical_formula_moiety         'C8 H6 I2 Mn N10'
_chemical_formula_sum            'C8 H6 I2 Mn N10'
_chemical_formula_weight         550.97
_chemical_name_common            '[Mn(Ipyz)2(N3)2]n'
_space_group_IT_number           61
_space_group_name_Hall           '-P 2ac 2ab'
_space_group_name_H-M_alt        'P b c a'
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   8.521(2)
_cell_length_b                   13.787(3)
_cell_length_c                   26.237(5)
_cell_measurement_temperature    100(2)
_cell_volume                     3082.2(11)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    2.375
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300424
Farrugia, Louis J.; Inorganic Chemistry  (2006) –; doi:10.1021/ic0512678

data_4300425
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic0512678
_journal_year                    2006
_chemical_formula_moiety         'Na2 Nb20 O36 Sc4'
_chemical_formula_sum            'Na2 Nb20 O36 Sc4'
_chemical_formula_weight         2660.02
_space_group_IT_number           148
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   8.0335(3)
_cell_length_b                   8.0335(3)
_cell_length_c                   14.5718(5)
_cell_measurement_temperature    293(2)
_cell_volume                     814.43(5)
_exptl_crystal_density_diffrn    5.424
_cod_original_sg_symbol_H-M      'R -3'
_cod_database_code               4300425
; Inorganic Chemistry  (2006) –; doi:10.1021/ic0512835

data_4300426
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic0512835
_journal_year                    2006
_chemical_formula_sum            'C14.38 H19.5 Ag2 B2.5 F8.63 N5.13 O'
_chemical_formula_weight         686.74
_space_group_IT_number           12
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 113.100(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   13.5924(15)
_cell_length_b                   27.841(3)
_cell_length_c                   13.2811(15)
_cell_measurement_temperature    273(2)
_cell_volume                     4623.0(9)
_diffrn_ambient_temperature      273(2)
_exptl_crystal_density_diffrn    1.973
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'C 2/m'
_cod_original_formula_sum        'C14.38 H19.50 Ag2 B2.50 F8.63 N5.13 O'
_cod_database_code               4300426
; Inorganic Chemistry  (2006) –; doi:10.1021/ic0512835

data_4300427
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic0512835
_journal_year                    2006
_chemical_formula_sum            'C28 H38 Ag4 B4 F16 N10'
_chemical_formula_weight         1293.40
_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                90.00
_cell_angle_beta                 96.381(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.8143(7)
_cell_length_b                   25.736(2)
_cell_length_c                   21.1937(18)
_cell_measurement_temperature    273(2)
_cell_volume                     4235.9(6)
_diffrn_ambient_temperature      273(2)
_exptl_crystal_density_diffrn    2.028
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4300427
; Inorganic Chemistry  (2006) –; doi:10.1021/ic0512835

data_4300428
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic0512835
_journal_year                    2006
_chemical_formula_sum            'C18 H24 Ag2 B2 F8 N6'
_chemical_formula_weight         713.79
_space_group_IT_number           1
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                110.934(6)
_cell_angle_beta                 97.226(6)
_cell_angle_gamma                96.238(6)
_cell_formula_units_Z            1
_cell_length_a                   6.8504(10)
_cell_length_b                   8.4092(12)
_cell_length_c                   11.5982(17)
_cell_measurement_temperature    110(2)
_cell_volume                     610.51(15)
_diffrn_ambient_temperature      110(2)
_exptl_crystal_density_diffrn    1.941
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300428
; Inorganic Chemistry  (2006) –; doi:10.1021/ic0512835

data_4300429
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic0512835
_journal_year                    2006
_chemical_formula_sum            'C12 H16 Ag B F4 N4'
_chemical_formula_weight         410.97
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   15.3184(13)
_cell_length_b                   10.4897(15)
_cell_length_c                   18.8193(17)
_cell_measurement_temperature    110(2)
_cell_volume                     3024.0(6)
_diffrn_ambient_temperature      110(2)
_exptl_crystal_density_diffrn    1.805
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300429
; Inorganic Chemistry  (2006) –; doi:10.1021/ic0512835

data_4300430
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic0512835
_journal_year                    2006
_chemical_formula_sum            'C12 H16 Ag B F4 N4'
_chemical_formula_weight         410.97
_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                90.00
_cell_angle_beta                 109.607(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.6991(4)
_cell_length_b                   14.1060(7)
_cell_length_c                   12.9311(7)
_cell_measurement_temperature    110(2)
_cell_volume                     1494.76(13)
_diffrn_ambient_temperature      110(2)
_exptl_crystal_density_diffrn    1.826
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4300430
; Inorganic Chemistry  (2006) –; doi:10.1021/ic0512835

data_4300431
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic0512835
_journal_year                    2006
_chemical_formula_sum            'C26 H24 Ag2 B2 F8 N6'
_chemical_formula_weight         809.87
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                92.490(5)
_cell_angle_beta                 96.249(5)
_cell_angle_gamma                93.248(5)
_cell_formula_units_Z            2
_cell_length_a                   7.1224(7)
_cell_length_b                   10.6180(10)
_cell_length_c                   19.1669(18)
_cell_measurement_temperature    110(2)
_cell_volume                     1436.8(2)
_diffrn_ambient_temperature      110(2)
_exptl_crystal_density_diffrn    1.872
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300431
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051284x

data_4300432
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051284x
_journal_year                    2006
_chemical_formula_sum            'C32 H32 Ag4 F12 N8 O8'
_chemical_formula_weight         1316.14
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.3431(4)
_cell_length_b                   17.0246(5)
_cell_length_c                   23.3149(8)
_cell_measurement_temperature    110(2)
_cell_volume                     4105.5(2)
_diffrn_ambient_temperature      110(2)
_exptl_crystal_density_diffrn    2.129
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300432
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051284x

data_4300433
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051284x
_journal_year                    2006
_chemical_formula_sum            'C14 H16 Ag2 F6 N4 O6 S2'
_chemical_formula_weight         730.17
_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                90.00
_cell_angle_beta                 91.743(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.2555(10)
_cell_length_b                   23.941(2)
_cell_length_c                   9.1244(8)
_cell_measurement_temperature    110(2)
_cell_volume                     2239.3(4)
_diffrn_ambient_temperature      110(2)
_exptl_crystal_density_diffrn    2.166
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4300433
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051284x

data_4300434
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051284x
_journal_year                    2006
_chemical_formula_sum            'C14 H16 Ag F3 N4 O2'
_chemical_formula_weight         437.18
_space_group_IT_number           14
_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                90.00
_cell_angle_beta                 108.001(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.5447(9)
_cell_length_b                   10.5573(7)
_cell_length_c                   12.9994(9)
_cell_measurement_temperature    110(2)
_cell_volume                     1637.3(2)
_diffrn_ambient_temperature      110(2)
_exptl_crystal_density_diffrn    1.773
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4300434
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051284x

data_4300435
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051284x
_journal_year                    2006
_chemical_formula_sum            'C13 H16 Ag F3 N4 O3 S'
_chemical_formula_weight         473.23
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.5817(8)
_cell_length_b                   10.4787(13)
_cell_length_c                   21.663(2)
_cell_measurement_temperature    110(2)
_cell_volume                     1721.1(3)
_diffrn_ambient_temperature      110(2)
_exptl_crystal_density_diffrn    1.826
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300435
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051284x

data_4300436
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051284x
_journal_year                    2006
_chemical_formula_sum            'C32 H27 Ag2 F6 N7 O4'
_chemical_formula_weight         903.35
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                78.317(2)
_cell_angle_beta                 64.335(2)
_cell_angle_gamma                75.003(2)
_cell_formula_units_Z            2
_cell_length_a                   11.6824(11)
_cell_length_b                   12.2492(11)
_cell_length_c                   13.2975(12)
_cell_measurement_temperature    273(2)
_cell_volume                     1647.8(3)
_diffrn_ambient_temperature      273(2)
_exptl_crystal_density_diffrn    1.821
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300436