LMucko/crystallography-open-database huggingface dataset:
Hulluri, Surya Prakash Rao; Shanmugam, Sivakumar; Journal of Organic Chemistry 70 (2005) 4524–4527; doi:10.1021/jo050308e

data_4020281
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              4524
_journal_page_last               4527
_journal_paper_doi               10.1021/jo050308e
_journal_volume                  70
_journal_year                    2005
_chemical_formula_sum            'C17 H17 N O8'
_chemical_formula_weight         363.32
_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                92.443(5)
_cell_angle_beta                 93.616(5)
_cell_angle_gamma                112.089(5)
_cell_formula_units_Z            2
_cell_length_a                   9.169(3)
_cell_length_b                   9.702(3)
_cell_length_c                   10.523(4)
_cell_measurement_temperature    293(2)
_cell_volume                     863.4(5)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.397
_cod_database_code               4020281
Russell J. Pearson; Kathryn M. Evans; Alexandra M. Z. Slawin; Douglas Philp; Nicholas J. Westwood; Journal of Organic Chemistry 70 (2005) 5055–5061; doi:10.1021/jo0503106

data_4020282
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5055
_journal_page_last               5061
_journal_paper_doi               10.1021/jo0503106
_journal_volume                  70
_journal_year                    2005
_chemical_formula_moiety         '2[C10 H8 Br2 N2 O2].C H Cl3.[C4 H10 O]0.50'
_chemical_formula_sum            'C23 H22 Br4 Cl3 N4 O4.5'
_chemical_formula_weight         852.44
_space_group_IT_number           80
_symmetry_cell_setting           tetragonal
_symmetry_space_group_name_Hall  'I 4bw'
_symmetry_space_group_name_H-M   'I 41'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   20.153(3)
_cell_length_b                   20.153(3)
_cell_length_c                   14.202(2)
_cell_measurement_temperature    93(2)
_cell_volume                     5767.8(14)
_diffrn_ambient_temperature      93(2)
_exptl_crystal_density_diffrn    1.963
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Tetragonal' changed to 'tetragonal'
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_formula_sum        'C23 H22 Br4 Cl3 N4 O4.50'
_cod_database_code               4020282
Russell J. Pearson; Kathryn M. Evans; Alexandra M. Z. Slawin; Douglas Philp; Nicholas J. Westwood; Journal of Organic Chemistry 70 (2005) 5055–5061; doi:10.1021/jo0503106

data_4020283
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5055
_journal_page_last               5061
_journal_paper_doi               10.1021/jo0503106
_journal_volume                  70
_journal_year                    2005
_chemical_formula_moiety         'C10 H8 Br2 N2'
_chemical_formula_sum            'C10 H8 Br2 N2'
_chemical_formula_weight         316.00
_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                 110.390(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   23.882(5)
_cell_length_b                   6.7351(16)
_cell_length_c                   13.747(4)
_cell_measurement_temperature    93(2)
_cell_volume                     2072.5(9)
_diffrn_ambient_temperature      93(2)
_exptl_crystal_density_diffrn    2.025
_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               4020283
Russell J. Pearson; Kathryn M. Evans; Alexandra M. Z. Slawin; Douglas Philp; Nicholas J. Westwood; Journal of Organic Chemistry 70 (2005) 5055–5061; doi:10.1021/jo0503106

data_4020284
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5055
_journal_page_last               5061
_journal_paper_doi               10.1021/jo0503106
_journal_volume                  70
_journal_year                    2005
_chemical_formula_moiety         'C10 H8 Br2 N2 O'
_chemical_formula_sum            'C10 H8 Br2 N2 O'
_chemical_formula_weight         332.00
_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                81.550(19)
_cell_angle_beta                 88.035(18)
_cell_angle_gamma                66.120(13)
_cell_formula_units_Z            2
_cell_length_a                   7.2876(14)
_cell_length_b                   7.3084(8)
_cell_length_c                   10.801(3)
_cell_measurement_temperature    93(2)
_cell_volume                     520.11(17)
_diffrn_ambient_temperature      93(2)
_exptl_crystal_density_diffrn    2.120
_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               4020284
Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle; Journal of Organic Chemistry 70 (2005) 5070–5085; doi:10.1021/jo050326w

data_4020285
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5070
_journal_page_last               5085
_journal_paper_doi               10.1021/jo050326w
_journal_volume                  70
_journal_year                    2005
_chemical_formula_sum            'C22 H29 N O7'
_chemical_formula_weight         419.46
_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                   7.85530(10)
_cell_length_b                   12.6178(2)
_cell_length_c                   21.7682(3)
_cell_measurement_temperature    223(2)
_cell_volume                     2157.59(5)
_diffrn_ambient_temperature      223(2)
_exptl_crystal_density_diffrn    1.291
_exptl_crystal_density_meas      ?
_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.

'_geom_bond_publ_flag' value 'Y' changed to 'y' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (62 times).

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

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'none' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_database_code               4020285
Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle; Journal of Organic Chemistry 70 (2005) 5070–5085; doi:10.1021/jo050326w

data_4020286
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5070
_journal_page_last               5085
_journal_paper_doi               10.1021/jo050326w
_journal_volume                  70
_journal_year                    2005
_chemical_formula_sum            'C23 H31 N O7'
_chemical_formula_weight         433.49
_space_group_IT_number           19
_space_group_name_Hall           'P 2ac 2ab'
_space_group_name_H-M_alt        'P 21 21 21'
_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                   7.183(3)
_cell_length_b                   12.295(4)
_cell_length_c                   25.615(12)
_cell_measurement_temperature    293(2)
_cell_volume                     2262.2(16)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.273
_exptl_crystal_density_meas      ?
_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.

'_geom_bond_publ_flag' value 'Y' changed to 'y' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (34 times).

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

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'none' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_database_code               4020286
Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle; Journal of Organic Chemistry 70 (2005) 5070–5085; doi:10.1021/jo050326w

data_4020287
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5070
_journal_page_last               5085
_journal_paper_doi               10.1021/jo050326w
_journal_volume                  70
_journal_year                    2005
_chemical_formula_sum            'C14 H21 N O4 Si'
_chemical_formula_weight         295.41
_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                 98.2760(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   7.00090(10)
_cell_length_b                   10.76630(10)
_cell_length_c                   10.51390(10)
_cell_measurement_temperature    220(2)
_cell_volume                     784.220(15)
_diffrn_ambient_temperature      220(2)
_exptl_crystal_density_diffrn    1.251
_exptl_crystal_density_meas      ?
_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.

'_geom_bond_publ_flag' value 'Y' changed to 'y' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (22 times).

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

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'none' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               4020287
Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle; Journal of Organic Chemistry 70 (2005) 5070–5085; doi:10.1021/jo050326w

data_4020288
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5070
_journal_page_last               5085
_journal_paper_doi               10.1021/jo050326w
_journal_volume                  70
_journal_year                    2005
_chemical_formula_sum            'C12 H15 N O4'
_chemical_formula_weight         237.25
_space_group_IT_number           19
_space_group_name_Hall           'P 2ac 2ab'
_space_group_name_H-M_alt        'P 21 21 21'
_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                   6.6205(17)
_cell_length_b                   10.695(5)
_cell_length_c                   16.226(7)
_cell_measurement_temperature    293(2)
_cell_volume                     1148.9(8)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.372
_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.

'_geom_bond_publ_flag' value 'Y' changed to 'y' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (19 times).

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4020288
Stephen Hanessian; Martin Tremblay; Mauro Marzi; Juan R. Del Valle; Journal of Organic Chemistry 70 (2005) 5070–5085; doi:10.1021/jo050326w

data_4020289
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5070
_journal_page_last               5085
_journal_paper_doi               10.1021/jo050326w
_journal_volume                  70
_journal_year                    2005
_chemical_absolute_configuration rmad
_chemical_formula_sum            'C16 H19 Cl F3 N O4'
_chemical_formula_weight         381.77
_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                 99.650(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.7304(6)
_cell_length_b                   6.0986(5)
_cell_length_c                   17.0394(13)
_cell_measurement_temperature    100(2)
_cell_volume                     894.40(12)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.418
_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.

'_geom_bond_publ_flag' value 'Y' changed to 'y' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (25 times).

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               4020289
Nurullah Saracoglu; Oktay Talaz; Akín Azizoglu; William H. Watson; Metin Balci; Journal of Organic Chemistry 70 (2005) 5403–5408; doi:10.1021/jo050327o

data_4020290
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5403
_journal_page_last               5408
_journal_paper_doi               10.1021/jo050327o
_journal_volume                  70
_journal_year                    2005
_chemical_formula_sum            'C19 H20 O5'
_chemical_formula_weight         328.35
_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                 98.777(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.1847(13)
_cell_length_b                   19.703(4)
_cell_length_c                   11.927(2)
_cell_measurement_temperature    294(2)
_cell_volume                     1668.6(5)
_diffrn_ambient_temperature      294(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/n'
_cod_database_code               4020290
Nurullah Saracoglu; Oktay Talaz; Akín Azizoglu; William H. Watson; Metin Balci; Journal of Organic Chemistry 70 (2005) 5403–5408; doi:10.1021/jo050327o

data_4020291
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5403
_journal_page_last               5408
_journal_paper_doi               10.1021/jo050327o
_journal_volume                  70
_journal_year                    2005
_chemical_formula_sum            'C19 H20 O5'
_chemical_formula_weight         328.35
_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                 98.075(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.325(3)
_cell_length_b                   11.534(4)
_cell_length_c                   17.382(7)
_cell_measurement_temperature    295(2)
_cell_volume                     1652.5(11)
_diffrn_ambient_temperature      295(2)
_exptl_crystal_density_diffrn    1.320
_exptl_crystal_density_meas      0
_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               4020291
Nurullah Saracoglu; Oktay Talaz; Akín Azizoglu; William H. Watson; Metin Balci; Journal of Organic Chemistry 70 (2005) 5403–5408; doi:10.1021/jo050327o

data_4020292
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5403
_journal_page_last               5408
_journal_paper_doi               10.1021/jo050327o
_journal_volume                  70
_journal_year                    2005
_chemical_formula_sum            'C19 H20 O5'
_chemical_formula_weight         328.35
_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                 104.623(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.549(4)
_cell_length_b                   10.483(4)
_cell_length_c                   14.482(5)
_cell_measurement_temperature    295(2)
_cell_volume                     1549.7(10)
_diffrn_ambient_temperature      295(2)
_exptl_crystal_density_diffrn    1.407
_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               4020292
Nurullah Saracoglu; Oktay Talaz; Akín Azizoglu; William H. Watson; Metin Balci; Journal of Organic Chemistry 70 (2005) 5403–5408; doi:10.1021/jo050327o

data_4020293
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5403
_journal_page_last               5408
_journal_paper_doi               10.1021/jo050327o
_journal_volume                  70
_journal_year                    2005
_chemical_formula_sum            'C21 H24 O6'
_chemical_formula_weight         372.40
_space_group_IT_number           11
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 98.305(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.3057(19)
_cell_length_b                   10.161(2)
_cell_length_c                   11.493(3)
_cell_measurement_temperature    293(2)
_cell_volume                     959.8(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.289
_exptl_crystal_density_meas      0
_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/m'
_cod_database_code               4020293
William W. Porter, III; Thomas P. Vaid; Journal of Organic Chemistry 70 (2005) 5028–5035; doi:10.1021/jo050328g

data_4020294
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5028
_journal_page_last               5035
_journal_paper_doi               10.1021/jo050328g
_journal_volume                  70
_journal_year                    2005
_chemical_formula_moiety         'C22 H18 N2 2+, 2 Cl -, 2 H2 O'
_chemical_formula_sum            'C22 H22 Cl2 N2 O2'
_chemical_formula_weight         417.32
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-I 2ya'
_symmetry_space_group_name_H-M   'I 1 2/a 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 115.421(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.2719(9)
_cell_length_b                   7.3616(4)
_cell_length_c                   17.7619(9)
_cell_measurement_temperature    223(2)
_cell_volume                     2039.74(19)
_diffrn_ambient_temperature      223(2)
_exptl_crystal_density_diffrn    1.359
_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      'I 2/a'
_cod_database_code               4020294