LMucko/crystallography-open-database huggingface dataset:
Stable Spirocyclic Neutral Radicals: Aluminum and Gallium Boraamidinates
C. T; B. Rene; E. Dana; F. Chantall; S. Gabriele; T.Heikki M.; Chemical Communications  (2005) –; doi:10.1039/b506253e

data_7100173
_publ_section_title
;
Stable Spirocyclic Neutral Radicals: Aluminum and
Gallium Boraamidinates
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506253e
_journal_year                    2005
_chemical_formula_moiety         'C28 H46 Al B2 N4'
_chemical_formula_sum            'C28 H46 Al B2 N4'
_chemical_formula_weight         487.29
_space_group_IT_number           60
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2n 2ab'
_symmetry_space_group_name_H-M   'P b c n'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.252(4)
_cell_length_b                   8.9108(18)
_cell_length_c                   20.212(4)
_cell_measurement_temperature    173(2)
_cell_volume                     3107.1(11)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.042
_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               7100173
Stable Spirocyclic Neutral Radicals: Aluminum and Gallium Boraamidinates
C. T; B. Rene; E. Dana; F. Chantall; S. Gabriele; T. Heikki M.; Chemical Communications  (2005) –; doi:10.1039/b506253e

data_7100174
_publ_section_title
;
Stable Spirocyclic Neutral Radicals: Aluminum and
Gallium Boraamidinates
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506253e
_journal_year                    2005
_chemical_formula_moiety         'C28 H46 B2 Ga N4'
_chemical_formula_sum            'C28 H46 B2 Ga N4'
_chemical_formula_weight         530.03
_space_group_IT_number           60
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2n 2ab'
_symmetry_space_group_name_H-M   'P b c n'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.173(3)
_cell_length_b                   8.9446(18)
_cell_length_c                   20.337(4)
_cell_measurement_temperature    173(2)
_cell_volume                     3123.8(11)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.127
_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               7100174
Easy activation of two CH bonds of an N-heterocyclic carbene N-methyl group
Javier A. Cabeza; I.del Rio; M. Gabriela Sanchez-Vega; Daniel Miguel; Chemical Communications  (2005) –; doi:10.1039/b506287j

data_7100175
_publ_section_title
;
Easy activation of two CH bonds of an N-heterocyclic
carbene N-methyl group
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506287j
_journal_year                    2005
_chemical_formula_sum            'C16 H8 N2 O11 Ru3'
_chemical_formula_weight         707.45
_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                 110.200(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.512(5)
_cell_length_b                   22.951(12)
_cell_length_c                   11.753(6)
_cell_measurement_temperature    296(2)
_cell_volume                     2155(2)
_diffrn_ambient_temperature      296(2)
_exptl_crystal_density_diffrn    2.181
_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               7100175
Easy activation of two CH bonds of an N-heterocyclic carbene N-methyl group
Javier A. Cabeza; I.del Rio; M. Gabriela Sanchez-Vega; Daniel Miguel; Chemical Communications  (2005) –; doi:10.1039/b506287j

data_7100176
_publ_section_title
;
Easy activation of two CH bonds of an N-heterocyclic
carbene N-methyl group
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506287j
_journal_year                    2005
_chemical_formula_sum            'C14 H8 N2 O9 Ru3'
_chemical_formula_weight         651.43
_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                 95.799(16)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.455(8)
_cell_length_b                   9.915(8)
_cell_length_c                   18.843(15)
_cell_measurement_temperature    296(2)
_cell_volume                     1943(3)
_diffrn_ambient_temperature      296(2)
_exptl_crystal_density_diffrn    2.227
_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               7100176
Second Generation N-Heterocyclic Carbene-Pt(0) Complexes as Efficient Catalysts for the Hydrosilylation of Alkenes.
I. Marko; Guillaume Berthon; Paul Branlard; Jean-Francois Briere; Olivier Buisine; J.-P. Declercq; Gerard Mignani; Sebastien Sterin; Bernard Tinant; Chemical Communications  (2005) –; doi:10.1039/b506369h

data_7100177
_publ_section_title
;
Second Generation N-Heterocyclic Carbene-Pt(0)
Complexes as Efficient Catalysts for the Hydrosilylation of Alkenes.
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506369h
_journal_year                    2005
_chemical_formula_sum            'C25 H44 N2 O Pt Si2'
_chemical_formula_weight         639.89
_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                96.35(2)
_cell_angle_beta                 93.73(2)
_cell_angle_gamma                111.56(2)
_cell_formula_units_Z            4
_cell_length_a                   12.915(4)
_cell_length_b                   13.155(4)
_cell_length_c                   18.436(7)
_cell_measurement_temperature    293(2)
_cell_volume                     2876.2(17)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.478
_cod_database_code               7100177
An unprecedented eight-connected self-penetrating network based on pentanuclear zinc clusters as building blocks
Enbo Wang; S. Batten; Chao Qin; Zhongmin Su; Xinlong Wang; Lin Xu; Chemical Communications  (2005) –; doi:10.1039/b506398a

data_7100178
_publ_section_title
;
An unprecedented eight-connected self-penetrating
network based on pentanuclear zinc clusters as building blocks
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506398a
_journal_year                    2005
_chemical_formula_sum            'C56 H34 N4 O18 Zn5'
_chemical_formula_weight         1377.72
_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                95.87(3)
_cell_angle_beta                 103.14(3)
_cell_angle_gamma                118.47(3)
_cell_formula_units_Z            1
_cell_length_a                   11.225(2)
_cell_length_b                   11.237(2)
_cell_length_c                   12.435(3)
_cell_measurement_temperature    283(2)
_cell_volume                     1301.4(4)
_diffrn_ambient_temperature      283(2)
_exptl_crystal_density_diffrn    1.758
_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               7100178
Doubly Ortho-linked Quinoxaline/Triarylamine Hybrid as a Bifunctional, Dipolar Electroluminescent Template for Optoelectronic Applications
Chien-Tien Chen; Chin-Hsiung Chien; Jin-Sheng Lin; Yi-Wen Lin; Murthy V. R. K. Moturu; Yu-Tai Tao; Chemical Communications  (2005) –; doi:10.1039/b506409k

data_7100179
_publ_section_title
;
Doubly Ortho-linked Quinoxaline/Triarylamine Hybrid as
a Bifunctional, Dipolar Electroluminescent Template for Optoelectronic
Applications
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506409k
_journal_year                    2005
_chemical_formula_sum            'C52 H32 N6'
_chemical_formula_weight         740.84
_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                86.745(3)
_cell_angle_beta                 82.838(3)
_cell_angle_gamma                61.349(3)
_cell_formula_units_Z            1
_cell_length_a                   8.6540(4)
_cell_length_b                   8.8680(5)
_cell_length_c                   14.3160(9)
_cell_measurement_temperature    295(2)
_cell_volume                     956.61(9)
_diffrn_ambient_temperature      295(2)
_exptl_crystal_density_diffrn    1.286
_refine_ls_R_factor_obs          0.0602
_refine_ls_wR_factor_obs         0.1484
_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               7100179
Doubly Ortho-linked Quinoxaline/Triarylamine Hybrid as a Bifunctional, Dipolar Electroluminescent Template for Optoelectronic Applications
Chien-Tien Chen; Chin-Hsiung Chien; Jin-Sheng Lin; Yi-Wen Lin; Murthy V. R. K. Moturu; Yu-Tai Tao; Chemical Communications  (2005) –; doi:10.1039/b506409k

data_7100180
_publ_section_title
;
Doubly Ortho-linked Quinoxaline/Triarylamine Hybrid as
a Bifunctional, Dipolar Electroluminescent Template for Optoelectronic
Applications
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506409k
_journal_year                    2005
_chemical_formula_moiety         'C65 H40 N6 '
_chemical_formula_sum            'C65 H40 N6'
_chemical_formula_weight         905.03
_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                90.0
_cell_angle_beta                 92.940(4)
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   10.655(2)
_cell_length_b                   23.169(4)
_cell_length_c                   24.861(4)
_cell_measurement_temperature    293
_cell_volume                     6128.9(16)
_diffrn_ambient_temperature      293
_exptl_crystal_density_diffrn    1.121
_refine_ls_R_factor_obs          0.092
_refine_ls_wR_factor_obs         0.118
_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 

The following automatic conversions were performed:

'_atom_site_thermal_displace_type' tag value 'Uij' was replaced with
'Uani' value 71 time.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C65 H40 N6 '
_cod_database_code               7100180
Doubly Ortho-linked Quinoxaline/Triarylamine Hybrid as a Bifunctional, Dipolar Electroluminescent Template for Optoelectronic Applications
Chien-Tien Chen; Chin-Hsiung Chien; Jin-Sheng Lin; Yi-Wen Lin; Murthy V. R. K. Moturu; Yu-Tai Tao; Chemical Communications  (2005) –; doi:10.1039/b506409k

data_7100181
_publ_section_title
;
Doubly Ortho-linked Quinoxaline/Triarylamine Hybrid as
a Bifunctional, Dipolar Electroluminescent Template for Optoelectronic
Applications
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506409k
_journal_year                    2005
_chemical_absolute_configuration unk
_chemical_formula_moiety         'C34 H21 N3'
_chemical_formula_sum            'C34 H21 N3'
_chemical_formula_weight         471.54
_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                   11.012(4)
_cell_length_b                   14.223(6)
_cell_length_c                   15.175(7)
_cell_measurement_temperature    293(2)
_cell_volume                     2376.7(17)
_diffrn_ambient_temperature      293(2)
_cod_database_code               7100181
Structure and Magnetic Properties of a new Ferrimagnet containing paramagnetic [Cr(CN)5(NO)]3 C building block.
Dai-Zheng Liao.; Peng Cheng.; Zong-Hui Jiang.; Yan Ouyang.; Kaziyoshi Yoshimura; Wei Zhang.; Huibo Zhou.; Mi-Na Zhu.; Chemical Communications  (2005) –; doi:10.1039/b506465a

data_7100182
_publ_section_title
;
Structure and Magnetic Properties of a new Ferrimagnet
containing paramagnetic [Cr(CN)5(NO)]3 C building block.
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506465a
_journal_year                    2005
_chemical_formula_sum            'C5 H2 Cr Mn N6 O2'
_chemical_formula_weight         285.07
_space_group_IT_number           225
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.718(2)
_cell_length_b                   10.718(2)
_cell_length_c                   10.718(2)
_cell_measurement_temperature    293(2)
_cell_volume                     1231.3(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.538
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Cubic' changed to 'cubic' 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               7100182
M. Suzuki; Chemical Communications  (2005) –; doi:10.1039/b506586k

data_7100183
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506586k
_journal_year                    2005
_chemical_formula_moiety         'C104 H98 F30 N8 '
_chemical_formula_sum            'C104 H98 F30 N8'
_chemical_formula_weight         2029.92
_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
_cell_angle_beta                 103.83(6)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   28.13(3)
_cell_length_b                   19.70(3)
_cell_length_c                   18.13(3)
_cell_measurement_temperature    123.1
_cell_volume                     9756(23)
_exptl_crystal_density_diffrn    1.382
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_original_formula_sum        'C104 H98 F30 N8 '
_cod_database_code               7100183
; Chemical Communications  (2005) –; doi:10.1039/b506586k

data_7100184
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506586k
_journal_year                    2005
_chemical_formula_moiety         'C70 H20 Cl6 F30 N6 '
_chemical_formula_sum            'C70 H20 Cl6 F30 N6'
_chemical_formula_weight         1727.64
_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
_cell_angle_beta                 90.13(5)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.731(8)
_cell_length_b                   20.42(1)
_cell_length_c                   22.93(1)
_cell_measurement_temperature    123.1
_cell_volume                     6429(6)
_exptl_crystal_density_diffrn    1.785
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C70 H20 Cl6 F30 N6 '
_cod_database_code               7100184
; Chemical Communications  (2005) –; doi:10.1039/b506586k

data_7100185
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506586k
_journal_year                    2005
_chemical_formula_moiety         'C70 H24 Cl4 F30 N6 '
_chemical_formula_sum            'C70 H24 Cl4 F30 N6'
_chemical_formula_weight         1660.76
_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
_cell_angle_beta                 106.88(6)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   34.11(5)
_cell_length_b                   6.491(9)
_cell_length_c                   14.94(3)
_cell_measurement_temperature    123.1
_cell_volume                     3165(8)
_exptl_crystal_density_diffrn    1.742
_cod_original_sg_symbol_H-M      'C 2'
_cod_original_formula_sum        'C70 H24 Cl4 F30 N6 '
_cod_database_code               7100185
A microporous scandium terephthalate, Sc~2~(O~2~CC~6~H~4~CO~2~)~3~, with high thermal stability
S.R.Miller; P.A.Wright; C.Serre; T.Loiseau; J.Marrot; G.Ferey; Chemical Communications  (2005) –; doi:10.1039/b506677h

data_7100186
_publ_section_title
;
A microporous scandium terephthalate, Sc~2~(O~2~CC~6~H~4~CO~2~)~3~,
with high thermal stability
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506677h
_journal_year                    2005
_chemical_formula_sum            'C24 H12 O12 Sc2'
_chemical_formula_weight         582.26
_space_group_IT_number           70
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-F 2uv 2vw'
_symmetry_space_group_name_H-M   'F d d d :2'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   8.7550(3)
_cell_length_b                   20.7786(7)
_cell_length_c                   34.4075(13)
_cell_measurement_temperature    293(2)
_cell_volume                     6259.3(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.236
_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      'F d d d'
_cod_database_code               7100186
Homologous, Long-chain Alkyl Dendrons Form Homologous Thin Films on Silver Oxide Surfaces.
Richard Gandour; B. Scott Day; Brett L. Kite; Melinda K. McPherson; John R. Morris; C. Slebodnik; Andre A. Williams; Chemical Communications  (2005) –; doi:10.1039/b506710c

data_7100187
_publ_section_title
;
Homologous, Long-chain Alkyl Dendrons Form Homologous
Thin Films on Silver Oxide Surfaces.
;
_journal_name_full               'Chemical Communications'
_journal_paper_doi               10.1039/b506710c
_journal_year                    2005
_chemical_formula_moiety         'C38 H71 N O7'
_chemical_formula_sum            'C38 H71 N O7'
_chemical_formula_weight         653.96
_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                82.928(8)
_cell_angle_beta                 89.815(10)
_cell_angle_gamma                81.801(10)
_cell_formula_units_Z            2
_cell_length_a                   5.6653(9)
_cell_length_b                   9.9138(10)
_cell_length_c                   35.868(3)
_cell_measurement_temperature    293(2)
_cell_volume                     1978.6(4)
_diffrn_ambient_temperature      100(2)
_diffrn_source_current           40
_diffrn_source_voltage           50
_exptl_crystal_density_diffrn    1.098
_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               7100187