LMucko/crystallography-open-database huggingface dataset:
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based Macrocycles Formed via Self-Assembly
Partha Sarathi Mukherjee; Neeladri Das; Yury K. Kryschenko; Atta M. Arif; Peter J. Stang; Journal of the American Chemical Society 126 (2004) 2464–2473; doi:10.1021/ja039235b

data_4100771
_publ_section_title
;
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based
Macrocycles Formed via Self-Assembly
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2464
_journal_page_last               2473
_journal_paper_doi               10.1021/ja039235b
_journal_volume                  126
_journal_year                    2004
_chemical_formula_sum            'C95 H147 Cl9 O8 P8 Pt4'
_chemical_formula_weight         2764.30
_space_group_IT_number           5
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 96.5331(8)
_cell_angle_gamma                90.00
_cell_formula_units_Z            6
_cell_length_a                   65.5820(13)
_cell_length_b                   13.9473(3)
_cell_length_c                   18.5091(4)
_cell_measurement_temperature    150(1)
_cell_volume                     16820.2(6)
_diffrn_ambient_temperature      150(1)
_exptl_crystal_density_diffrn    1.637
_cod_original_sg_symbol_H-M      'C 2'
_cod_database_code               4100771
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based Macrocycles Formed via Self-Assembly
Partha Sarathi Mukherjee; Neeladri Das; Yury K. Kryschenko; Atta M. Arif; Peter J. Stang; Journal of the American Chemical Society 126 (2004) 2464–2473; doi:10.1021/ja039235b

data_4100772
_publ_section_title
;
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based
Macrocycles Formed via Self-Assembly
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2464
_journal_page_last               2473
_journal_paper_doi               10.1021/ja039235b
_journal_volume                  126
_journal_year                    2004
_chemical_formula_sum            'C90 H146 N2 O10 P8 Pt4'
_chemical_formula_weight         2444.21
_space_group_IT_number           61
_space_group_name_Hall           '-P 2ac 2ab'
_space_group_name_H-M_alt        'P b c a'
_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            4
_cell_length_a                   17.2967(2)
_cell_length_b                   21.7453(2)
_cell_length_c                   26.3952(3)
_cell_measurement_temperature    150(1)
_cell_volume                     9927.81(19)
_diffrn_ambient_temperature      150(1)
_exptl_crystal_density_diffrn    1.635
_cod_database_code               4100772
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based Macrocycles Formed via Self-Assembly
Partha Sarathi Mukherjee; Neeladri Das; Yury K. Kryschenko; Atta M. Arif; Peter J. Stang; Journal of the American Chemical Society 126 (2004) 2464–2473; doi:10.1021/ja039235b

data_4100773
_publ_section_title
;
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based
Macrocycles Formed via Self-Assembly
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2464
_journal_page_last               2473
_journal_paper_doi               10.1021/ja039235b
_journal_volume                  126
_journal_year                    2004
_chemical_formula_sum            'C90 H146 Cl6 O8 P8 Pt4'
_chemical_formula_weight         2596.89
_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                83.6936(11)
_cell_angle_beta                 82.6978(9)
_cell_angle_gamma                63.3960(10)
_cell_formula_units_Z            1
_cell_length_a                   12.2930(2)
_cell_length_b                   13.3346(2)
_cell_length_c                   18.4568(3)
_cell_measurement_temperature    150(1)
_cell_volume                     2678.43(7)
_diffrn_ambient_temperature      150(1)
_exptl_crystal_density_diffrn    1.610
_cod_database_code               4100773
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based Macrocycles Formed via Self-Assembly
Partha Sarathi Mukherjee; Neeladri Das; Yury K. Kryschenko; Atta M. Arif; Peter J. Stang; Journal of the American Chemical Society 126 (2004) 2464–2473; doi:10.1021/ja039235b

data_4100774
_publ_section_title
;
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based
Macrocycles Formed via Self-Assembly
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2464
_journal_page_last               2473
_journal_paper_doi               10.1021/ja039235b
_journal_volume                  126
_journal_year                    2004
_chemical_formula_sum            'C108 H156 Cl12 O8 P8 Pt4'
_chemical_formula_weight         3035.85
_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                65.8038(9)
_cell_angle_beta                 89.4500(12)
_cell_angle_gamma                88.8228(13)
_cell_formula_units_Z            1
_cell_length_a                   10.1898(1)
_cell_length_b                   17.4960(4)
_cell_length_c                   20.0771(4)
_cell_measurement_temperature    150(1)
_cell_volume                     3264.21(10)
_diffrn_ambient_temperature      150(1)
_exptl_crystal_density_diffrn    1.544
_cod_database_code               4100774
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based Macrocycles Formed via Self-Assembly
Partha Sarathi Mukherjee; Neeladri Das; Yury K. Kryschenko; Atta M. Arif; Peter J. Stang; Journal of the American Chemical Society 126 (2004) 2464–2473; doi:10.1021/ja039235b

data_4100775
_publ_section_title
;
Design, Synthesis, and Crystallographic Studies of Neutral Platinum-Based
Macrocycles Formed via Self-Assembly
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2464
_journal_page_last               2473
_journal_paper_doi               10.1021/ja039235b
_journal_volume                  126
_journal_year                    2004
_chemical_formula_sum            'C107 H155 Cl9 N4 O8 P8 Pt4'
_chemical_formula_weight         2972.52
_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                110.7639(15)
_cell_angle_beta                 92.4544(21)
_cell_angle_gamma                102.6123(18)
_cell_formula_units_Z            1
_cell_length_a                   10.2370(3)
_cell_length_b                   15.5079(4)
_cell_length_c                   21.7184(7)
_cell_measurement_temperature    150(1)
_cell_volume                     3118.72(16)
_diffrn_ambient_temperature      150(1)
_exptl_crystal_density_diffrn    1.583
_cod_database_code               4100775
Total Synthesis of the Polyene-Polyol Macrolide RK-397, Featuring Cross-Couplings of Alkynylepoxide Modules
Svetlana A. Burova; Frank E. McDonald; Journal of the American Chemical Society 126 (2004) 2495–2500; doi:10.1021/ja039618+

data_4100776
_publ_contact_author_address
;
Emory University
Department of Chemistry
X-ray Crystallography Laboratory
Atlanta GA 30322-2210
USA
;
_publ_contact_author_email       khardca@emory.edu
_publ_contact_author_fax         404-727-6586
_publ_contact_author_name        'Kenneth I. Hardcastle'
_publ_contact_author_phone       404-727-6140
_publ_section_title
;
Total Synthesis of the Polyene-Polyol Macrolide RK-397, Featuring
Cross-Couplings of Alkynylepoxide Modules
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2495
_journal_page_last               2500
_journal_paper_doi               10.1021/ja039618+
_journal_volume                  126
_journal_year                    2004
_chemical_formula_moiety         'C16 H26 O3'
_chemical_formula_sum            'C16 H26 O3'
_chemical_formula_weight         266.37
_space_group_IT_number           5
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 96.553(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   40.5363(8)
_cell_length_b                   7.6077(1)
_cell_length_c                   10.7656(2)
_cell_measurement_temperature    173(2)
_cell_volume                     3298.29(10)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.073
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'C 2'
_cod_database_code               4100776
Probing the Ruthenium-Cumulene Bonding Interaction: Synthesis and Spectroscopic Studies of Vinylidene- and Allenylidene-Ruthenium Complexes Supported by Tetradentate Macrocyclic Tertiary Amine and Comparisons with Diphosphine Analogues of Ruthenium and Osmium
Chun-Yuen Wong; Chi-Ming Che; Michael C. W. Chan; King-Hung Leung; David Lee Phillips; Nianyong Zhu; Journal of the American Chemical Society 126 (2004) 2501–2514; doi:10.1021/ja0380648

data_4100777
_publ_section_title
;
Probing the Ruthenium-Cumulene Bonding Interaction: Synthesis and
Spectroscopic Studies of Vinylidene- and Allenylidene-Ruthenium
Complexes Supported by Tetradentate Macrocyclic Tertiary Amine and
Comparisons with Diphosphine Analogues of Ruthenium and Osmium
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2501
_journal_page_last               2514
_journal_paper_doi               10.1021/ja0380648
_journal_volume                  126
_journal_year                    2004
_chemical_formula_moiety         'C25 H44 Cl3 F6 N4 P Ru'
_chemical_formula_sum            'C25 H44 Cl3 F6 N4 P Ru'
_chemical_formula_weight         753.03
_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                90.00
_cell_angle_beta                 99.31(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   16.827(3)
_cell_length_b                   11.191(2)
_cell_length_c                   34.119(7)
_cell_measurement_temperature    301(2)
_cell_volume                     6340(2)
_diffrn_ambient_temperature      301(2)
_exptl_crystal_density_diffrn    1.578
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4100777
Probing the Ruthenium-Cumulene Bonding Interaction: Synthesis and Spectroscopic Studies of Vinylidene- and Allenylidene-Ruthenium Complexes Supported by Tetradentate Macrocyclic Tertiary Amine and Comparisons with Diphosphine Analogues of Ruthenium and Osmium
Chun-Yuen Wong; Chi-Ming Che; Michael C. W. Chan; King-Hung Leung; David Lee Phillips; Nianyong Zhu; Journal of the American Chemical Society 126 (2004) 2501–2514; doi:10.1021/ja0380648

data_4100778
_publ_section_title
;
Probing the Ruthenium-Cumulene Bonding Interaction: Synthesis and
Spectroscopic Studies of Vinylidene- and Allenylidene-Ruthenium
Complexes Supported by Tetradentate Macrocyclic Tertiary Amine and
Comparisons with Diphosphine Analogues of Ruthenium and Osmium
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2501
_journal_page_last               2514
_journal_paper_doi               10.1021/ja0380648
_journal_volume                  126
_journal_year                    2004
_chemical_formula_moiety         'C32 H50 Cl3 F6 N4 P Ru'
_chemical_formula_sum            'C32 H50 Cl3 F6 N4 P Ru'
_chemical_formula_weight         843.15
_space_group_IT_number           7
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P -2yac'
_symmetry_space_group_name_H-M   'P 1 n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 93.14(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   10.599(2)
_cell_length_b                   9.2400(18)
_cell_length_c                   18.651(4)
_cell_measurement_temperature    301(2)
_cell_volume                     1823.8(6)
_diffrn_ambient_temperature      301(2)
_exptl_crystal_density_diffrn    1.535
_cod_original_sg_symbol_H-M      'P n'
_cod_database_code               4100778
Probing the Ruthenium-Cumulene Bonding Interaction: Synthesis and Spectroscopic Studies of Vinylidene- and Allenylidene-Ruthenium Complexes Supported by Tetradentate Macrocyclic Tertiary Amine and Comparisons with Diphosphine Analogues of Ruthenium and Osmium
Chun-Yuen Wong; Chi-Ming Che; Michael C. W. Chan; King-Hung Leung; David Lee Phillips; Nianyong Zhu; Journal of the American Chemical Society 126 (2004) 2501–2514; doi:10.1021/ja0380648

data_4100779
_publ_section_title
;
Probing the Ruthenium-Cumulene Bonding Interaction: Synthesis and
Spectroscopic Studies of Vinylidene- and Allenylidene-Ruthenium
Complexes Supported by Tetradentate Macrocyclic Tertiary Amine and
Comparisons with Diphosphine Analogues of Ruthenium and Osmium
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2501
_journal_page_last               2514
_journal_paper_doi               10.1021/ja0380648
_journal_volume                  126
_journal_year                    2004
_chemical_formula_moiety         'C31 H46 Cl F6 N4 P Ru'
_chemical_formula_sum            'C31 H46 Cl F6 N4 P Ru'
_chemical_formula_weight         756.21
_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                   8.875(2)
_cell_length_b                   11.351(2)
_cell_length_c                   33.375(7)
_cell_measurement_temperature    293(2)
_cell_volume                     3362.2(12)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.494
_cod_database_code               4100779
Probing the Ruthenium-Cumulene Bonding Interaction: Synthesis and Spectroscopic Studies of Vinylidene- and Allenylidene-Ruthenium Complexes Supported by Tetradentate Macrocyclic Tertiary Amine and Comparisons with Diphosphine Analogues of Ruthenium and Osmium
Chun-Yuen Wong; Chi-Ming Che; Michael C. W. Chan; King-Hung Leung; David Lee Phillips; Nianyong Zhu; Journal of the American Chemical Society 126 (2004) 2501–2514; doi:10.1021/ja0380648

data_4100780
_publ_section_title
;
Probing the Ruthenium-Cumulene Bonding Interaction: Synthesis and
Spectroscopic Studies of Vinylidene- and Allenylidene-Ruthenium
Complexes Supported by Tetradentate Macrocyclic Tertiary Amine and
Comparisons with Diphosphine Analogues of Ruthenium and Osmium
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2501
_journal_page_last               2514
_journal_paper_doi               10.1021/ja0380648
_journal_volume                  126
_journal_year                    2004
_chemical_formula_moiety         'C33 H50 Cl F6 N4 P Ru'
_chemical_formula_sum            'C33 H50 Cl F6 N4 P Ru'
_chemical_formula_weight         784.26
_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                 133.14(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   14.517(3)
_cell_length_b                   31.896(6)
_cell_length_c                   10.380(2)
_cell_measurement_temperature    301(2)
_cell_volume                     3507.1(12)
_diffrn_ambient_temperature      301(2)
_exptl_crystal_density_diffrn    1.485
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4100780
An Example of O2 Binding in a Cobalt(II) Corrole System and High-Valent Cobalt-Cyano and Cobalt-Alkynyl Complexes
Bobby Ramdhanie; Joshua Telser; Andrea Caneschi; Lev N. Zakharov; Arnold L. Rheingold; David P. Goldberg; Journal of the American Chemical Society 126 (2004) 2515–2525; doi:10.1021/ja036983s

data_4100781
_publ_section_title
;
An Example of O2 Binding in a Cobalt(II) Corrole System and High-Valent
Cobalt-Cyano and Cobalt-Alkynyl Complexes
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2515
_journal_page_last               2525
_journal_paper_doi               10.1021/ja036983s
_journal_volume                  126
_journal_year                    2004
_chemical_formula_sum            'C123 H127 Co N7 Si'
_chemical_formula_weight         1790.34
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                71.0260(10)
_cell_angle_beta                 73.1090(10)
_cell_angle_gamma                89.8000(10)
_cell_formula_units_Z            2
_cell_length_a                   15.7889(11)
_cell_length_b                   18.3915(12)
_cell_length_c                   19.4754(13)
_cell_measurement_temperature    150(2)
_cell_volume                     5091.4(6)
_diffrn_ambient_temperature      150(2)
_exptl_crystal_density_diffrn    1.168
_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               4100781
Reactions of a Platinum(III) Dimeric Complex with Alkynes in Water: Novel Approach to α-Aminoketone, α-Iminoketone, and α,β-Diimine via Ketonyl-Pt(III) Dinuclear Complexes
Masahiko Ochiai; Yong-Shou Lin; Jun Yamada; Hanae Misawa; Saiko Arai; Kazuko Matsumoto; Journal of the American Chemical Society 126 (2004) 2536–2545; doi:10.1021/ja0302634

data_4100782
_publ_section_title
;
Reactions of a Platinum(III) Dimeric Complex with Alkynes in Water: Novel
Approach to \a-Aminoketone, \a-Iminoketone, and \a,\b-Diimine via
Ketonyl-Pt(III) Dinuclear Complexes
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2536
_journal_page_last               2545
_journal_paper_doi               10.1021/ja0302634
_journal_volume                  126
_journal_year                    2004
_chemical_formula_sum            'C15 H27 N9 O13 Pt2'
_chemical_formula_weight         931.64
_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                84.335(3)
_cell_angle_beta                 78.348(4)
_cell_angle_gamma                89.358(3)
_cell_formula_units_Z            2
_cell_length_a                   9.6251(17)
_cell_length_b                   10.1925(18)
_cell_length_c                   15.986(3)
_cell_measurement_temperature    496(2)
_cell_volume                     1528.4(5)
_diffrn_ambient_temperature      496(2)
_exptl_crystal_density_diffrn    2.024
_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               4100782
Reactions of a Platinum(III) Dimeric Complex with Alkynes in Water: Novel Approach to α-Aminoketone, α-Iminoketone, and α,β-Diimine via Ketonyl-Pt(III) Dinuclear Complexes
Masahiko Ochiai; Yong-Shou Lin; Jun Yamada; Hanae Misawa; Saiko Arai; Kazuko Matsumoto; Journal of the American Chemical Society 126 (2004) 2536–2545; doi:10.1021/ja0302634

data_4100783
_publ_section_title
;
Reactions of a Platinum(III) Dimeric Complex with Alkynes in Water: Novel
Approach to \a-Aminoketone, \a-Iminoketone, and \a,\b-Diimine via
Ketonyl-Pt(III) Dinuclear Complexes
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              2536
_journal_page_last               2545
_journal_paper_doi               10.1021/ja0302634
_journal_volume                  126
_journal_year                    2004
_chemical_formula_sum            'C14.5 H43 N9 O13.5 Pt2'
_chemical_formula_weight         949.76
_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                106.8670(10)
_cell_angle_beta                 100.7410(10)
_cell_angle_gamma                93.3400(10)
_cell_formula_units_Z            2
_cell_length_a                   9.6133(6)
_cell_length_b                   10.0893(7)
_cell_length_c                   17.1561(11)
_cell_measurement_temperature    293(2)
_cell_volume                     1553.30(18)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    2.031
_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_original_formula_sum        'C14.50 H43 N9 O13.50 Pt2'
_cod_database_code               4100783