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

data_4300355
_journal_name_full               'Inorganic Chemistry'
_journal_year                    2006
_chemical_formula_sum            'C20 H32 Eu N7 O13'
_chemical_formula_weight         730.49
_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                   10.243(2)
_cell_length_b                   14.424(3)
_cell_length_c                   18.920(4)
_cell_measurement_temperature    296(2)
_cell_volume                     2795.4(10)
_diffrn_ambient_temperature      296(2)
_exptl_crystal_density_diffrn    1.736
_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               4300355
; Inorganic Chemistry  (2006) –; doi:

data_4300356
_journal_name_full               'Inorganic Chemistry'
_journal_year                    2006
_chemical_formula_sum            'C14 H28 Eu N7 O13'
_chemical_formula_weight         654.39
_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                 100.6360(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.6595(5)
_cell_length_b                   16.2631(8)
_cell_length_c                   14.3906(7)
_cell_measurement_temperature    173(2)
_cell_volume                     2451.8(2)
_diffrn_ambient_temperature      173(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               4300356
; Inorganic Chemistry  (2006) –; doi:

data_4300357
_journal_name_full               'Inorganic Chemistry'
_journal_year                    2006
_chemical_formula_sum            'C20 H32 Gd N7 O13'
_chemical_formula_weight         735.78
_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                   10.1554(4)
_cell_length_b                   14.3680(6)
_cell_length_c                   18.8152(8)
_cell_measurement_temperature    153(2)
_cell_volume                     2745.4(2)
_diffrn_ambient_temperature      153(2)
_exptl_crystal_density_diffrn    1.780
_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               4300357
; Inorganic Chemistry  (2006) –; doi:

data_4300358
_journal_name_full               'Inorganic Chemistry'
_journal_year                    2006
_chemical_formula_sum            'C14 H28 Gd N7 O13'
_chemical_formula_weight         659.68
_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                 98.1890(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.0844(5)
_cell_length_b                   11.3437(4)
_cell_length_c                   15.8016(6)
_cell_measurement_temperature    153(2)
_cell_volume                     2321.45(15)
_diffrn_ambient_temperature      153(2)
_exptl_crystal_density_diffrn    1.887
_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               4300358
Design of novel bilayer compounds of CPO-8 type containing 1D channels
Kjell Ove Kongshaug; Fjellvag, Helmer; Inorganic Chemistry  (2006) –; doi:10.1021/ic050662v

data_4300359
_publ_section_title
;
Design of novel bilayer compounds of CPO-8 type containing 1D channels
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050662v
_journal_year                    2006
_chemical_formula_sum            'C13 N2 O4 Zn'
_chemical_formula_weight         313.53
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_cell_angle_alpha                90.0
_cell_angle_beta                 107.6361(19)
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   11.58082(32)
_cell_length_b                   7.70682(20)
_cell_length_c                   15.9980(4)
_cell_volume                     1360.74(7)
_cod_depositor_comments
;
 Updating space group information and adding the symmetry operation list.

 Antanas Vaitkus,
 2018-06-15

The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (53 times).

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               4300359
Design of novel bilayer compounds of CPO-8 type containing 1D channels
Kjell Ove Kongshaug; Fjellvag, Helmer; Inorganic Chemistry  (2006) –; doi:10.1021/ic050662v

data_4300360
_publ_section_title
;
Design of novel bilayer compounds of CPO-8 type containing 1D channels
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050662v
_journal_year                    2006
_chemical_formula_sum            'C14 N2 O4 Zn'
_chemical_formula_weight         325.54
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_cell_angle_alpha                90.0
_cell_angle_beta                 113.1355(24)
_cell_angle_gamma                90.0
_cell_formula_units_Z            8
_cell_length_a                   25.9183(9)
_cell_length_b                   7.43553(30)
_cell_length_c                   16.2652(6)
_cell_volume                     2882.47(20)
_cod_depositor_comments
;
 Updating space group information and adding the symmetry operation list.

 Antanas Vaitkus,
 2018-06-14

The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (57 times).

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               4300360
Design of novel bilayer compounds of CPO-8 type containing 1D channels
Kjell Ove Kongshaug; Fjellvag, Helmer; Inorganic Chemistry  (2006) –; doi:10.1021/ic050662v

data_4300361
_publ_section_title
;
Design of novel bilayer compounds of CPO-8 type containing 1D channels
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050662v
_journal_year                    2006
_chemical_formula_sum            'C14 N2 O4 Zn'
_chemical_formula_weight         325.54
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_cell_angle_alpha                90.0
_cell_angle_beta                 113.3313(24)
_cell_angle_gamma                90.0
_cell_formula_units_Z            8
_cell_length_a                   26.0449(9)
_cell_length_b                   7.44816(29)
_cell_length_c                   16.2399(6)
_cell_volume                     2892.72(20)
_cod_depositor_comments
;
 Updating space group information and adding the symmetry operation list.

 Antanas Vaitkus,
 2018-06-14

The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (57 times).

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               4300361
Design of novel bilayer compounds of CPO-8 type containing 1D channels
Kjell Ove Kongshaug; Fjellvag, Helmer; Inorganic Chemistry  (2006) –; doi:10.1021/ic050662v

data_4300362
_publ_section_title
;
Design of novel bilayer compounds of CPO-8 type containing 1D channels
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050662v
_journal_year                    2006
_chemical_formula_sum            'C29 N4 O8 Zn2'
_chemical_formula_weight         663.10
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   16.0405(4)
_cell_length_b                   7.65135(18)
_cell_length_c                   25.1087(5)
_cell_volume                     3081.64(14)
_cod_depositor_comments
;
The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (114 times).

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4300362
Design of novel bilayer compounds of CPO-8 type containing 1D channels
Kjell Ove Kongshaug; Fjellvag, Helmer; Inorganic Chemistry  (2006) –; doi:10.1021/ic050662v

data_4300363
_publ_section_title
;
Design of novel bilayer compounds of CPO-8 type containing 1D channels
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050662v
_journal_year                    2006
_chemical_formula_sum            'C13 H16 N2 O5 Zn'
_chemical_formula_weight         345.65
_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                 92.921(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.2615(18)
_cell_length_b                   7.6501(12)
_cell_length_c                   16.284(3)
_cell_measurement_temperature    273(2)
_cell_volume                     1401.0(4)
_diffrn_ambient_temperature      298
_exptl_crystal_density_diffrn    1.639
_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               4300363
Design of novel bilayer compounds of CPO-8 type containing 1D channels
Kjell Ove Kongshaug; Fjellvag, Helmer; Inorganic Chemistry  (2006) –; doi:10.1021/ic050662v

data_4300364
_publ_section_title
;
Design of novel bilayer compounds of CPO-8 type containing 1D channels
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050662v
_journal_year                    2006
_chemical_formula_sum            'C52 H60 N8 O28 Zn4'
_chemical_formula_weight         1506.56
_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                 108.963(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            1
_cell_length_a                   12.4676(9)
_cell_length_b                   7.6792(6)
_cell_length_c                   16.1832(12)
_cell_measurement_temperature    273(2)
_cell_volume                     1465.31(19)
_diffrn_ambient_temperature      298
_exptl_crystal_density_diffrn    1.707
_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               4300364
Design of novel bilayer compounds of CPO-8 type containing 1D channels
Kjell Ove Kongshaug; Fjellvag, Helmer; Inorganic Chemistry  (2006) –; doi:10.1021/ic050662v

data_4300365
_publ_section_title
;
Design of novel bilayer compounds of CPO-8 type containing 1D channels
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050662v
_journal_year                    2006
_chemical_formula_sum            'C14 H15 N2 O6.5 Zn'
_chemical_formula_weight         380.65
_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                 114.0290(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   26.5106(19)
_cell_length_b                   7.4518(5)
_cell_length_c                   16.3890(12)
_cell_measurement_temperature    273(2)
_cell_volume                     2957.1(4)
_diffrn_ambient_temperature      298
_exptl_crystal_density_diffrn    1.710
_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_original_formula_sum        'C14 H15 N2 O6.50 Zn'
_cod_database_code               4300365
Design of novel bilayer compounds of CPO-8 type containing 1D channels
Kjell Ove Kongshaug; Fjellvag, Helmer; Inorganic Chemistry  (2006) –; doi:10.1021/ic050662v

data_4300366
_publ_section_title
;
Design of novel bilayer compounds of CPO-8 type containing 1D channels
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050662v
_journal_year                    2006
_chemical_formula_sum            'C14 H16 N2 O6.5 Zn'
_chemical_formula_weight         381.66
_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                 113.588(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   26.544(6)
_cell_length_b                   7.4487(16)
_cell_length_c                   16.339(4)
_cell_measurement_temperature    273(2)
_cell_volume                     2960.6(11)
_diffrn_ambient_temperature      298
_exptl_crystal_density_diffrn    1.713
_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_original_formula_sum        'C14 H16 N2 O6.50 Zn'
_cod_database_code               4300366
Design of novel bilayer compounds of CPO-8 type containing 1D channels
Kjell Ove Kongshaug; Fjellvag, Helmer; Inorganic Chemistry  (2006) –; doi:10.1021/ic050662v

data_4300367
_publ_section_title
;
Design of novel bilayer compounds of CPO-8 type containing 1D channels
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050662v
_journal_year                    2006
_chemical_formula_sum            'C116 H144 N16 O56 Zn8'
_chemical_formula_weight         3181.43
_space_group_IT_number           33
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            1
_cell_length_a                   16.205(4)
_cell_length_b                   7.6783(16)
_cell_length_c                   25.247(5)
_cell_measurement_temperature    273(2)
_cell_volume                     3141.2(12)
_diffrn_ambient_temperature      298
_exptl_crystal_density_diffrn    1.682
_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_original_sg_symbol_H-M      'P ? ? ?'
_cod_database_code               4300367
; Inorganic Chemistry  (2006) –; doi:10.1021/ic050841c

data_4300368
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050841c
_journal_year                    2006
_chemical_formula_moiety         'C60 H52 Cu N4 O2, C H2 Cl2'
_chemical_formula_sum            'C61 H54 Cl2 Cu N4 O2'
_chemical_formula_weight         1009.52
_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                86.078(8)
_cell_angle_beta                 82.261(7)
_cell_angle_gamma                64.438(9)
_cell_formula_units_Z            2
_cell_length_a                   12.989(3)
_cell_length_b                   14.384(3)
_cell_length_c                   14.553(3)
_cell_measurement_temperature    105
_cell_volume                     2430.4(9)
_diffrn_ambient_temperature      105
_exptl_crystal_density_diffrn    1.380
_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               4300368
; Inorganic Chemistry  (2006) –; doi:10.1021/ic050841c

data_4300369
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050841c
_journal_year                    2006
_chemical_formula_moiety         '2(C60 H52 N4 Ni O2), 3(C H Cl3), C H4 O'
_chemical_formula_sum            'C124 H111 Cl9 N8 Ni2 O5'
_chemical_formula_weight         2229.68
_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                70.580(5)
_cell_angle_beta                 73.315(5)
_cell_angle_gamma                88.440(6)
_cell_formula_units_Z            2
_cell_length_a                   14.932(2)
_cell_length_b                   17.009(2)
_cell_length_c                   22.907(3)
_cell_measurement_temperature    105
_cell_volume                     5240.9(12)
_diffrn_ambient_temperature      105
_exptl_crystal_density_diffrn    1.413
_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               4300369
Coordination complexes with cis-TCNE Radical Anion ligands. Models of M[TCNE]~2~ Magnets.
Wang, Guangbin; Zhu, Huifang; Fan, Jian; Slebodnick, Carla; Yee, Gordon T.; Inorganic Chemistry  (2006) –; doi:10.1021/ic050854q

data_4300370
_publ_section_title
;
 Coordination complexes with cis-TCNE Radical Anion ligands.
 Models of M[TCNE]~2~ Magnets.
;
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic050854q
_journal_year                    2006
_chemical_formula_moiety         '2(C26 H18 Mn N16), C4 H10 O, C2 H3 N'
_chemical_formula_sum            'C58 H49 Mn2 N33 O'
_chemical_formula_weight         1334.18
_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                89.524(6)
_cell_angle_beta                 80.612(7)
_cell_angle_gamma                64.543(8)
_cell_formula_units_Z            2
_cell_length_a                   11.4726(10)
_cell_length_b                   12.1751(9)
_cell_length_c                   25.367(2)
_cell_measurement_temperature    100(2)
_cell_volume                     3148.8(4)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.407
_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               4300370