LMucko/crystallography-open-database huggingface dataset:
Binding of organometallic ruthenium(II) and osmium(II) complexes to an oligonucleotide: a combined mass spectometric and theoretical study.
Dorcier, Antoine; Dyson, Paul J.; Gossens, Christian; Rothlisberger, Ursula; Scopelliti, Rosario; Organometallics  (2005) –; doi:10.1021/om049025n

data_4060320
_publ_section_title
;
Binding of organometallic ruthenium(II) and osmium(II) complexes to
an oligonucleotide: a combined mass spectometric and theoretical study.
;
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om049025n
_journal_year                    2005
_chemical_formula_sum            'C42 H52 B F4 P Ru2'
_chemical_formula_weight         876.76
_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                 92.226(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.2717(7)
_cell_length_b                   17.0632(14)
_cell_length_c                   19.4068(12)
_cell_measurement_temperature    153(2)
_cell_volume                     3729.7(4)
_diffrn_ambient_temperature      153(2)
_exptl_crystal_density_diffrn    1.561
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4060320
Jean-Yves Salaun; Organometallics  (2005) –; doi:

data_4060321
_journal_name_full               Organometallics
_journal_year                    2005
_chemical_formula_sum            'C9 H6 Fe O8'
_chemical_formula_weight         297.99
_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                87.08(1)
_cell_angle_beta                 89.52(1)
_cell_angle_gamma                68.99(1)
_cell_formula_units_Z            2
_cell_length_a                   6.3286(7)
_cell_length_b                   8.776(1)
_cell_length_c                   10.946(1)
_cell_measurement_temperature    100
_cell_volume                     566.7(2)
_diffrn_ambient_temperature      100
_exptl_crystal_density_diffrn    1.75
_cod_depositor_comments
;
The following automatic conversions were performed:

'_atom_site_adp_type' tag value 'Uij' was replaced with 'Uani' value
18 times.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_original_formula_sum        'C9 H6 O8 Fe'
_cod_database_code               4060321
; Organometallics  (2005) –; doi:

data_4060322
_journal_name_full               Organometallics
_journal_year                    2005
_chemical_formula_sum            'C8 H2 Fe O7'
_chemical_formula_weight         265.95
_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                 105.260(7)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.5836(9)
_cell_length_b                   6.9549(5)
_cell_length_c                   12.4252(9)
_cell_measurement_temperature    288
_cell_volume                     965.7(2)
_diffrn_ambient_temperature      288
_exptl_crystal_density_diffrn    1.83
_cod_depositor_comments
;
The following automatic conversions were performed:

'_atom_site_adp_type' tag value 'Uij' was replaced with 'Uani' value
16 times.

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        'C8 H2 O7 Fe'
_cod_database_code               4060322
Synthesis and Reactivity of New [kappa2-P,N]Pt(II) Complexes of Diisopropyphosphino-Substituted 2-Dimethylaminoindene
; Organometallics  (2005) –; doi:10.1021/om049034w

data_4060325
_publ_section_title
;
 Synthesis and Reactivity of New [kappa2-P,N]Pt(II) Complexes of
 Diisopropyphosphino-Substituted 2-Dimethylaminoindene
;
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om049034w
_journal_year                    2005
_chemical_formula_sum            'C17 H26 Cl2 N P Pt'
_chemical_formula_weight         541.35
_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                   7.6580(3)
_cell_length_b                   15.2323(6)
_cell_length_c                   16.8331(7)
_cell_measurement_temperature    193(2)
_cell_volume                     1963.56(14)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.831
_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               4060325
Synthesis and Reactivity of New [kappa2-P,N]Pt(II) Complexes of Diisopropyphosphino-Substituted 2-Dimethylaminoindene
; Organometallics  (2005) –; doi:10.1021/om049034w

data_4060326
_publ_section_title
;
 Synthesis and Reactivity of New [kappa2-P,N]Pt(II) Complexes of
 Diisopropyphosphino-Substituted 2-Dimethylaminoindene
;
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om049034w
_journal_year                    2005
_chemical_formula_sum            'C20 H34 N P Pt S'
_chemical_formula_weight         546.60
_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                 114.546(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.3880(10)
_cell_length_b                   21.813(2)
_cell_length_c                   10.5700(10)
_cell_measurement_temperature    193(2)
_cell_volume                     2178.6(4)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.666
_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               4060326
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060327
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C18 H30 N2 Ni O2 Si2'
_chemical_formula_weight         421.33
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 96.5200(12)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   15.8990(6)
_cell_length_b                   6.8500(2)
_cell_length_c                   21.3210(9)
_cell_measurement_temperature    230.0(2)
_cell_volume                     2307.01(15)
_diffrn_ambient_temperature      230.0(2)
_exptl_crystal_density_diffrn    1.213
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4060327
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060328
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C24 H46 N4 Ni O2 Si2'
_chemical_formula_weight         537.54
_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                 101.0250(8)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.8590(2)
_cell_length_b                   13.9810(3)
_cell_length_c                   20.4510(6)
_cell_measurement_temperature    230.0(2)
_cell_volume                     3047.56(12)
_diffrn_ambient_temperature      230.0(2)
_exptl_crystal_density_diffrn    1.172
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4060328
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060329
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C26 H46 N4 Ni2 Si4'
_chemical_formula_weight         644.45
_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                106.974(2)
_cell_angle_beta                 108.096(2)
_cell_angle_gamma                91.455(2)
_cell_formula_units_Z            2
_cell_length_a                   11.3643(5)
_cell_length_b                   12.0823(6)
_cell_length_c                   13.7054(7)
_cell_measurement_temperature    230.0(2)
_cell_volume                     1696.84(14)
_diffrn_ambient_temperature      230.0(2)
_exptl_crystal_density_diffrn    1.261
_cod_database_code               4060329
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060330
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C38 H78 Br2 Li2 N8 Ni Si4'
_chemical_formula_weight         991.85
_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                 98.7610(8)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.5880(2)
_cell_length_b                   15.1020(3)
_cell_length_c                   32.8200(8)
_cell_measurement_temperature    230.0(2)
_cell_volume                     5676.6(2)
_diffrn_ambient_temperature      230.0(2)
_exptl_crystal_density_diffrn    1.161
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4060330
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060331
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C6 H16 N2 Ni0.5'
_chemical_formula_weight         145.56
_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                 113.926(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   8.5850(3)
_cell_length_b                   14.3240(6)
_cell_length_c                   10.0170(4)
_cell_measurement_temperature    230.0(2)
_cell_volume                     1125.96(8)
_diffrn_ambient_temperature      230.0(2)
_exptl_crystal_density_diffrn    1.717
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_original_formula_sum        'C6 H16 N2 Ni0.50'
_cod_database_code               4060331
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060332
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C38 H78 Br2 Li2 N8 Ni Si4'
_chemical_formula_weight         991.85
_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                 98.7610(8)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.5880(2)
_cell_length_b                   15.1020(3)
_cell_length_c                   32.8200(8)
_cell_measurement_temperature    230.0(2)
_cell_volume                     5676.6(2)
_diffrn_ambient_temperature      230.0(2)
_exptl_crystal_density_diffrn    1.161
_cod_duplicate_entry             4060330
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4060332
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060333
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C19 H32 N2 Ni O2 Si2'
_chemical_formula_weight         435.36
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   17.6130(2)
_cell_length_b                   12.8460(3)
_cell_length_c                   20.9800(3)
_cell_measurement_temperature    230.0(2)
_cell_volume                     4746.86(14)
_diffrn_ambient_temperature      230.0(2)
_exptl_crystal_density_diffrn    1.218
_cod_original_sg_symbol_H-M      Pbca
_cod_database_code               4060333
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060334
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C25 H48 N4 Ni O2 Si2'
_chemical_formula_weight         551.56
_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                 103.606(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   14.9190(11)
_cell_length_b                   10.9080(8)
_cell_length_c                   20.112(2)
_cell_measurement_temperature    230.0(2)
_cell_volume                     3181.1(5)
_diffrn_ambient_temperature      230.0(2)
_exptl_crystal_density_diffrn    1.152
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4060334
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060335
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_moiety         'C28 H50 N4 Ni1 Si4'
_chemical_formula_sum            'C28 H50 N4 Ni Si4'
_chemical_formula_weight         613.78
_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                 129.923(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   26.7070(12)
_cell_length_b                   8.8830(6)
_cell_length_c                   20.4120(12)
_cell_measurement_temperature    230.0(1)
_cell_volume                     3713.8(4)
_diffrn_ambient_temperature      230.0(1)
_exptl_crystal_density_diffrn    1.098
_cod_original_sg_symbol_H-M      C2/c
_cod_original_formula_sum        'C28 H50 N4 Ni1 Si4'
_cod_database_code               4060335
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition Polymerization of Norbornene, the Oligomerization of Ethylene, and the Dimerization of Propylene
Nelkenbaum, Elza; Kapon, Moshe; Eisen, Moris S.; Organometallics 24 (2005) 2645–2659; doi:10.1021/om0490379

data_4060336
_publ_section_title
;
Synthesis and Molecular Structures of Neutral Nickel Complexes. Catalytic 
Activity of (Benzamidinato)(acetylacetonato)nickel for the Addition 
Polymerization of Norbornene, the Oligomerization of Ethylene, 
and the Dimerization of Propylene
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              2645
_journal_page_last               2659
_journal_paper_doi               10.1021/om0490379
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C12 H16 N2 Ni'
_chemical_formula_weight         246.98
_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                 99.037(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   9.809(2)
_cell_length_b                   16.995(4)
_cell_length_c                   15.197(3)
_cell_measurement_temperature    230.0(2)
_cell_volume                     2502.0(10)
_diffrn_ambient_temperature      230.0(2)
_exptl_crystal_density_diffrn    1.311
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               4060336