LMucko/crystallography-open-database huggingface dataset:
; Journal of the American Chemical Society  (2005) –; doi:

data_4100560
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_moiety         'C25 H34 Br1 Mo1 O3 P1'
_chemical_formula_sum            'C25 H34 Br Mo O3 P'
_chemical_formula_weight         589.34
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                104.57(3)
_cell_angle_beta                 108.57(3)
_cell_angle_gamma                103.77(3)
_cell_formula_units_Z            2
_cell_length_a                   10.903(2)
_cell_length_b                   11.395(2)
_cell_length_c                   12.157(2)
_cell_measurement_temperature    298(2)
_cell_measurement_wavelength     0.71073
_cell_volume                     1299.8(5)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.506
_cod_database_code               4100560
; Journal of the American Chemical Society  (2005) –; doi:

data_4100561
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_moiety         'C26 H37 Mo1 O3 P1 S1'
_chemical_formula_sum            'C26 H37 Mo O3 P S'
_chemical_formula_weight         556.53
_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
_cell_angle_beta                 94.72(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.9000(18)
_cell_length_b                   23.129(5)
_cell_length_c                   13.248(3)
_cell_measurement_temperature    100(2)
_cell_volume                     2717.8(9)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.36
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4100561
; Journal of the American Chemical Society  (2005) –; doi:

data_4100562
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C27 H29 Br Cl N O3 S2'
_chemical_formula_weight         594.99
_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                   6.7184(13)
_cell_length_b                   17.702(4)
_cell_length_c                   22.591(5)
_cell_measurement_temperature    293(2)
_cell_volume                     2686.8(9)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.471
_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               4100562
; Journal of the American Chemical Society  (2005) –; doi:

data_4100563
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C22 H28 Cl N O3 S2'
_chemical_formula_weight         454.02
_space_group_IT_number           5
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 101.60(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   34.764(7)
_cell_length_b                   7.7896(16)
_cell_length_c                   8.8527(18)
_cell_measurement_temperature    293(2)
_cell_volume                     2348.3(8)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.284
_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'
_cod_database_code               4100563
; Journal of the American Chemical Society  (2005) –; doi:

data_4100564
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C21 H12.5 Cl N O3 S2'
_chemical_formula_weight         426.39
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 91.42(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.5875(15)
_cell_length_b                   28.279(6)
_cell_length_c                   10.105(2)
_cell_measurement_temperature    180(2)
_cell_volume                     2167.6(7)
_diffrn_ambient_temperature      180(2)
_exptl_crystal_density_diffrn    1.307
_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'
_cod_original_formula_sum        'C21 H12.50 Cl N O3 S2'
_cod_database_code               4100564
; Journal of the American Chemical Society  (2005) –; doi:

data_4100565
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_moiety
'C30 H30 N15 O28 P3 U3 . NA4.25 . 16.5(H2 O)'
_chemical_formula_sum            'C30 H63 N15 Na4.25 O44.5 P3 U3'
_chemical_formula_weight         2250.66
_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                60.028(15)
_cell_angle_beta                 89.981(17)
_cell_angle_gamma                89.782(17)
_cell_formula_units_Z            2
_cell_length_a                   8.4610(10)
_cell_length_b                   26.688(4)
_cell_length_c                   26.690(4)
_cell_measurement_temperature    298(2)
_cell_volume                     5220.8(13)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.432
_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 

2023-09-06
Z value and formula fixed to values more according to usual
chemical conventions.                 miguel
;
_cod_original_formula_weight         4501.32
_cod_original_formula_moiety
'2(C30 H30 N15 O28 P3 U3) . NA8.50 . 33(H2 O)'
_cod_original_formula_units_Z            1
_cod_original_sg_symbol_H-M      P1
_cod_original_formula_sum        'C60 H126 N30 Na8.50 O89 P6 U6'
_cod_database_code               4100565
; Journal of the American Chemical Society  (2005) –; doi:

data_4100566
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_moiety         'C40 H49 Fe N6, C18 H36 K N2 O6'
_chemical_formula_sum            'C58 H85 Fe K N8 O6'
_chemical_formula_weight         1085.29
_chemical_name_common            '[Fe(OEP)(2-MeIm)]K(222)'
_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                 94.371(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.9232(1)
_cell_length_b                   19.6316(2)
_cell_length_c                   22.5922(3)
_cell_measurement_temperature    100(2)
_cell_volume                     5715.04(11)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.261
_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               4100566
; Journal of the American Chemical Society  (2005) –; doi:

data_4100567
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_moiety
'C48 H33 Fe N6, C28 H36 K N2 O6, C3 H2.50 Cl0.50'
_chemical_formula_sum            'C69 H71.5 Cl0.5 Fe K N8 O6'
_chemical_formula_weight         1221.52
_chemical_name_common            '[Fe(TPP)(2-MeIm)]K(222)'
_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                 95.74(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.431(3)
_cell_length_b                   21.078(4)
_cell_length_c                   23.879(5)
_cell_measurement_temperature    100(2)
_cell_volume                     6225(2)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.303
_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_original_formula_sum        'C69 H71.50 Cl0.50 Fe K N8 O6'
_cod_database_code               4100567
A Simple Route to Difluorocarbene and Perfluoroalkylidene Complexes of Iridium
Russell P. Hughes; Roman B. Laritchev; Jian Yuan; James A. Golen; Adam N. Rucker; Arnold L. Rheingold; Journal of the American Chemical Society 127 (2005) 15020–15021; doi:10.1021/ja055166k

data_4100568
_publ_section_title
;
A Simple Route to Difluorocarbene and Perfluoroalkylidene Complexes of
Iridium
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              15020
_journal_page_last               15021
_journal_paper_doi               10.1021/ja055166k
_journal_volume                  127
_journal_year                    2005
_chemical_formula_sum            'C14 H24 F2 Ir P'
_chemical_formula_weight         453.50
_space_group_IT_number           62
_space_group_name_Hall           '-P 2ac 2n'
_space_group_name_H-M_alt        'P n m a'
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   16.115(5)
_cell_length_b                   11.761(3)
_cell_length_c                   8.482(3)
_cell_measurement_temperature    100(2)
_cell_volume                     1607.6(8)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.874
_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               4100568
A Simple Route to Difluorocarbene and Perfluoroalkylidene Complexes of Iridium
Russell P. Hughes; Roman B. Laritchev; Jian Yuan; James A. Golen; Adam N. Rucker; Arnold L. Rheingold; Journal of the American Chemical Society 127 (2005) 15020–15021; doi:10.1021/ja055166k

data_4100569
_publ_section_title
;
A Simple Route to Difluorocarbene and Perfluoroalkylidene Complexes of
Iridium
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              15020
_journal_page_last               15021
_journal_paper_doi               10.1021/ja055166k
_journal_volume                  127
_journal_year                    2005
_chemical_formula_moiety         'C15 H24 F4 Ir P'
_chemical_formula_sum            'C15 H24 F4 Ir P'
_chemical_formula_weight         503.51
_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                109.330(2)
_cell_angle_beta                 100.572(2)
_cell_angle_gamma                90.329(2)
_cell_formula_units_Z            8
_cell_length_a                   12.6958(17)
_cell_length_b                   17.033(2)
_cell_length_c                   17.415(2)
_cell_measurement_temperature    100(2)
_cell_volume                     3484.2(8)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.920
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               4100569
; Journal of the American Chemical Society  (2005) –; doi:

data_4100570
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C242 H208 Cd32 N4 S50'
_chemical_formula_weight         8371.92
_chemical_name_common            COV-1CdS-TMDPy
_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                 94.9820(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   31.5032(5)
_cell_length_b                   30.1445(5)
_cell_length_c                   61.3699(10)
_cell_measurement_temperature    150(2)
_cell_volume                     58059.6(16)
_diffrn_ambient_temperature      150(2)
_exptl_crystal_density_diffrn    1.916
_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      C2/c
_cod_database_code               4100570
; Journal of the American Chemical Society  (2005) –; doi:

data_4100571
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C289 H244 Cd32 N2 P2 S52'
_chemical_formula_weight         9070.72
_chemical_name_common            COV-2CdS-TMDPy
_space_group_IT_number           73
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-I 2b 2c'
_symmetry_space_group_name_H-M   'I 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                   26.3539(8)
_cell_length_b                   34.5150(10)
_cell_length_c                   73.258(2)
_cell_measurement_temperature    150(2)
_cell_volume                     66636(4)
_diffrn_ambient_temperature      150(2)
_exptl_crystal_density_diffrn    1.808
_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               4100571
; Journal of the American Chemical Society  (2005) –; doi:

data_4100572
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C166 H138 Cd17 N2 S30'
_chemical_formula_weight         5033.38
_chemical_name_common            COV-3CdS-BPy
_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                 101.9450(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            12
_cell_length_a                   30.0750(5)
_cell_length_b                   58.6144(10)
_cell_length_c                   31.8999(5)
_cell_measurement_temperature    90(2)
_cell_volume                     55016.4(16)
_diffrn_ambient_temperature      90(2)
_exptl_crystal_density_diffrn    1.823
_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               4100572
; Journal of the American Chemical Society  (2005) –; doi:

data_4100573
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C97 H84 Cd8 N2 S15'
_chemical_formula_weight         2657.76
_chemical_name_common            COV-4CdS-TMDPy
_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                 108.5460(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   23.4374(4)
_cell_length_b                   18.9054(3)
_cell_length_c                   24.3535(4)
_cell_measurement_temperature    273(2)
_cell_volume                     10230.5(3)
_diffrn_ambient_temperature      273(2)
_exptl_crystal_density_diffrn    1.726
_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               4100573
; Journal of the American Chemical Society  (2005) –; doi:

data_4100574
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C16 H20 I N O3'
_chemical_formula_weight         401.23
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 118.124(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.7703(8)
_cell_length_b                   12.6055(12)
_cell_length_c                   9.0914(9)
_cell_measurement_temperature    295(2)
_cell_volume                     886.42(15)
_diffrn_ambient_temperature      295(2)
_exptl_crystal_density_diffrn    1.503
_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'
_cod_database_code               4100574
; Journal of the American Chemical Society  (2005) –; doi:

data_4100575
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C16 H21 N O3'
_chemical_formula_weight         275.34
_space_group_IT_number           18
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2 2ab'
_symmetry_space_group_name_H-M   'P 21 21 2'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.5886(8)
_cell_length_b                   18.9715(13)
_cell_length_c                   7.2785(5)
_cell_measurement_temperature    295(2)
_cell_volume                     1600.20(19)
_diffrn_ambient_temperature      295(2)
_exptl_crystal_density_diffrn    1.143
_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               4100575
; Journal of the American Chemical Society  (2005) –; doi:

data_4100576
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_sum            'C17 H16 Br N O'
_chemical_formula_weight         330.22
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 108.4030(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.6587(5)
_cell_length_b                   8.6285(5)
_cell_length_c                   10.8061(6)
_cell_measurement_temperature    295(2)
_cell_volume                     766.05(8)
_diffrn_ambient_temperature      295(2)
_exptl_crystal_density_diffrn    1.432
_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'
_cod_database_code               4100576