LMucko/crystallography-open-database huggingface dataset:
Preparation, Structure, and Olefin Polymerization Behavior of Functionalized Nickel(II) N-Heterocyclic Carbene Complexes
Wang, Xin; Liu, Shuang; Jin, Guo-Xin; Organometallics 23 (2004) 6002–6007; doi:10.1021/om049467z

data_4061296
_publ_section_title
;
 Preparation, Structure, and Olefin Polymerization Behavior of
 Functionalized Nickel(II) N-Heterocyclic Carbene Complexes
;
_journal_coden_ASTM              ORGND7
_journal_issue                   25
_journal_name_full               Organometallics
_journal_page_first              6002
_journal_page_last               6007
_journal_paper_doi               10.1021/om049467z
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C35 H44 Cl2 N6 Ni O4'
_chemical_formula_weight         742.37
_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                95.772(4)
_cell_angle_beta                 105.255(4)
_cell_angle_gamma                115.401(4)
_cell_formula_units_Z            2
_cell_length_a                   11.861(4)
_cell_length_b                   12.744(4)
_cell_length_c                   13.811(4)
_cell_measurement_temperature    293(2)
_cell_volume                     1763.9(9)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.398
_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               4061296
; Organometallics  (2004) –; doi:10.1021/om0494972

data_4061297
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om0494972
_journal_year                    2004
_chemical_formula_moiety         'C9 H24 O6 Si3 '
_chemical_formula_sum            'C9 H24 O6 Si3'
_chemical_formula_weight         312.54
_space_group_IT_number           33
_space_group_name_Hall           'P 2c -2n'
_space_group_name_H-M_alt        'P n a 21'
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   18.832(4)
_cell_length_b                   6.332(1)
_cell_length_c                   13.685(3)
_cell_measurement_temperature    113.1
_cell_volume                     1631.8(6)
_exptl_crystal_density_diffrn    1.272
_cod_original_formula_sum        'C9 H24 O6 Si3 '
_cod_database_code               4061297
A New Family of P,N-Chelates: Stereoselective Synthesis of 2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
Leca, François; Lescop, Christophe; Toupet, Loïc; Réau, Régis; Organometallics 23 (2004) 6191–6201; doi:10.1021/om049510i

data_4061298
_publ_section_title
;
A New Family of P,N-Chelates: Stereoselective Synthesis of
2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
;
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              6191
_journal_page_last               6201
_journal_paper_doi               10.1021/om049510i
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C23 H26 Cl2 N P Pd S'
_chemical_formula_weight         556.78
_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                 106.6950(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.3320(2)
_cell_length_b                   17.1370(5)
_cell_length_c                   13.1100(4)
_cell_measurement_temperature    293(2)
_cell_volume                     2223.40(10)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.663
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4061298
A New Family of P,N-Chelates: Stereoselective Synthesis of 2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
Leca, François; Lescop, Christophe; Toupet, Loïc; Réau, Régis; Organometallics 23 (2004) 6191–6201; doi:10.1021/om049510i

data_4061299
_publ_section_title
;
A New Family of P,N-Chelates: Stereoselective Synthesis of
2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
;
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              6191
_journal_page_last               6201
_journal_paper_doi               10.1021/om049510i
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C25.5 H24 Cl5 N2 P Pd'
_chemical_formula_weight         673.08
_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                 98.388(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   14.985(5)
_cell_length_b                   9.785(5)
_cell_length_c                   37.375(5)
_cell_measurement_temperature    293(2)
_cell_volume                     5422(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.649
_cod_depositor_comments
;

2021-12-16
Z value and formula fixed to values more according to usual
chemical conventions.                 miguel
;
_cod_original_formula_sum            'C51 H48 Cl10 N4 P2 Pd2'
_cod_original_formula_weight         1346.17
_cod_original_formula_units_Z            4
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4061299
A New Family of P,N-Chelates: Stereoselective Synthesis of 2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
Leca, François; Lescop, Christophe; Toupet, Loïc; Réau, Régis; Organometallics 23 (2004) 6191–6201; doi:10.1021/om049510i

data_4061300
_publ_section_title
;
A New Family of P,N-Chelates: Stereoselective Synthesis of
2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
;
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              6191
_journal_page_last               6201
_journal_paper_doi               10.1021/om049510i
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C25 H29 Cl4 N2 P Pd'
_chemical_formula_weight         636.67
_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                   8.7170(2)
_cell_length_b                   16.2360(3)
_cell_length_c                   18.9070(4)
_cell_measurement_temperature    293(2)
_cell_volume                     2675.89(10)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.580
_cod_database_code               4061300
A New Family of P,N-Chelates: Stereoselective Synthesis of 2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
Leca, François; Lescop, Christophe; Toupet, Loïc; Réau, Régis; Organometallics 23 (2004) 6191–6201; doi:10.1021/om049510i

data_4061301
_publ_section_title
;
A New Family of P,N-Chelates: Stereoselective Synthesis of
2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
;
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              6191
_journal_page_last               6201
_journal_paper_doi               10.1021/om049510i
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C25 H22 Cl2 N P Pd'
_chemical_formula_weight         544.7
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-I 2ya'
_symmetry_space_group_name_H-M   'I 1 2/a 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 104.844(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   21.587(5)
_cell_length_b                   8.979(5)
_cell_length_c                   26.183(5)
_cell_measurement_temperature    293(2)
_cell_volume                     4906(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.475
_cod_original_sg_symbol_H-M      'I 2/a'
_cod_database_code               4061301
A New Family of P,N-Chelates: Stereoselective Synthesis of 2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
Leca, François; Lescop, Christophe; Toupet, Loïc; Réau, Régis; Organometallics 23 (2004) 6191–6201; doi:10.1021/om049510i

data_4061302
_publ_section_title
;
A New Family of P,N-Chelates: Stereoselective Synthesis of
2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
;
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              6191
_journal_page_last               6201
_journal_paper_doi               10.1021/om049510i
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C23.5 H26 Cl3 N P Pd S'
_chemical_formula_weight         598.23
_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                 106.722(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.866(5)
_cell_length_b                   15.475(5)
_cell_length_c                   16.973(5)
_cell_measurement_temperature    293(2)
_cell_volume                     2733.3(17)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.454
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_original_formula_sum        'C23.50 H26 Cl3 N P Pd S'
_cod_database_code               4061302
A New Family of P,N-Chelates: Stereoselective Synthesis of 2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
Leca, François; Lescop, Christophe; Toupet, Loïc; Réau, Régis; Organometallics 23 (2004) 6191–6201; doi:10.1021/om049510i

data_4061303
_publ_section_title
;
A New Family of P,N-Chelates: Stereoselective Synthesis of
2-Pyridyl-2-phospholenes in the Coordination Sphere of Pd(II)-Complexes.
;
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              6191
_journal_page_last               6201
_journal_paper_doi               10.1021/om049510i
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C24 H22 Cl4 N P Pt S'
_chemical_formula_weight         724.35
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 96.230(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.504(5)
_cell_length_b                   17.436(5)
_cell_length_c                   15.476(5)
_cell_measurement_temperature    293(2)
_cell_volume                     2549.4(17)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.887
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4061303
Electron-Rich Diplatinum(0) Metallocryptate Promoting Novel Successive Encapsulation of Acidic Hydrides
Goto, Eri; Usuki, Miho; Takenaka, Hiroe; Sakai, Ken; Tanase, Tomoaki; Organometallics 23 (2004) 6042–6051; doi:10.1021/om049548v

data_4061304
_publ_section_title
;
 Electron-Rich Diplatinum(0) Metallocryptate Promoting Novel Successive
 Encapsulation of Acidic Hydrides
;
_journal_coden_ASTM              ORGND7
_journal_issue                   25
_journal_name_full               Organometallics
_journal_page_first              6042
_journal_page_last               6051
_journal_paper_doi               10.1021/om049548v
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C116 H98 Cl4 F6 N8 Na O2 P7 Pt2'
_chemical_formula_weight         2521.89
_space_group_IT_number           2
_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                71.112(6)
_cell_angle_beta                 88.849(3)
_cell_angle_gamma                70.010(1)
_cell_formula_units_Z            2
_cell_length_a                   15.2997(9)
_cell_length_b                   19.8498(7)
_cell_length_c                   21.980(2)
_cell_measurement_temperature    153.2
_cell_volume                     5904.5(7)
_exptl_crystal_density_diffrn    1.418
_cod_original_formula_sum        'C116 H98 Cl4 F6 N8 Na O2 P7 Pt2 '
_cod_database_code               4061304
Electron-Rich Diplatinum(0) Metallocryptate Promoting Novel Successive Encapsulation of Acidic Hydrides
Goto, Eri; Usuki, Miho; Takenaka, Hiroe; Sakai, Ken; Tanase, Tomoaki; Organometallics 23 (2004) 6042–6051; doi:10.1021/om049548v

data_4061305
_publ_section_title
;
 Electron-Rich Diplatinum(0) Metallocryptate Promoting Novel Successive
 Encapsulation of Acidic Hydrides
;
_journal_coden_ASTM              ORGND7
_journal_issue                   25
_journal_name_full               Organometallics
_journal_page_first              6042
_journal_page_last               6051
_journal_paper_doi               10.1021/om049548v
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C116 H96 Cl4 F12 N8 Na O0.5 P8 Pt2'
_chemical_formula_weight         2640.84
_space_group_IT_number           2
_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                83.871(8)
_cell_angle_beta                 74.999(8)
_cell_angle_gamma                89.986(9)
_cell_formula_units_Z            2
_cell_length_a                   17.0841(9)
_cell_length_b                   18.063(2)
_cell_length_c                   18.5949(8)
_cell_measurement_temperature    153.2
_cell_volume                     5508.8(6)
_exptl_crystal_density_diffrn    1.592
_cod_original_formula_sum        'C116 H96 Cl4 F12 N8 Na O0.50 P8 Pt2 '
_cod_database_code               4061305
Electron-Rich Diplatinum(0) Metallocryptate Promoting Novel Successive Encapsulation of Acidic Hydrides
Goto, Eri; Usuki, Miho; Takenaka, Hiroe; Sakai, Ken; Tanase, Tomoaki; Organometallics 23 (2004) 6042–6051; doi:10.1021/om049548v

data_4061306
_publ_section_title
;
 Electron-Rich Diplatinum(0) Metallocryptate Promoting Novel Successive
 Encapsulation of Acidic Hydrides
;
_journal_coden_ASTM              ORGND7
_journal_issue                   25
_journal_name_full               Organometallics
_journal_page_first              6042
_journal_page_last               6051
_journal_paper_doi               10.1021/om049548v
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety         'C119.50 H106 Cl3 F18 N8 Na O1.50 P9 Pt2 '
_chemical_formula_sum            'C119.5 H106 Cl3 F18 N8 Na O1.5 P9 Pt2'
_chemical_formula_weight         2818.47
_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
_cell_angle_beta                 90.151(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   23.0221(7)
_cell_length_b                   28.1459(8)
_cell_length_c                   18.2233(5)
_cell_measurement_temperature    153.2
_cell_volume                     11808.3(6)
_exptl_crystal_density_diffrn    1.585
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_original_formula_sum        'C119.50 H106 Cl3 F18 N8 Na O1.50 P9 Pt2 '
_cod_database_code               4061306
Electron-Rich Diplatinum(0) Metallocryptate Promoting Novel Successive Encapsulation of Acidic Hydrides
Goto, Eri; Usuki, Miho; Takenaka, Hiroe; Sakai, Ken; Tanase, Tomoaki; Organometallics 23 (2004) 6042–6051; doi:10.1021/om049548v

data_4061307
_publ_section_title
;
 Electron-Rich Diplatinum(0) Metallocryptate Promoting Novel Successive
 Encapsulation of Acidic Hydrides
;
_journal_coden_ASTM              ORGND7
_journal_issue                   25
_journal_name_full               Organometallics
_journal_page_first              6042
_journal_page_last               6051
_journal_paper_doi               10.1021/om049548v
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C117 H104 Cl6 F6 N8 Na O4 P7 Pd2'
_chemical_formula_weight         2465.47
_space_group_IT_number           2
_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                70.81(1)
_cell_angle_beta                 88.80(2)
_cell_angle_gamma                70.33(1)
_cell_formula_units_Z            2
_cell_length_a                   15.366(1)
_cell_length_b                   19.9417(4)
_cell_length_c                   22.096(2)
_cell_measurement_temperature    153.2
_cell_volume                     5990(1)
_exptl_crystal_density_diffrn    1.367
_cod_database_code               4061307
A Planar Dimeric Six-Membered Spirane Aluminum Hydrazide: Synthesis, X-ray Crystal Structure and Theoretical Studies of [LAlN(Me)NH]~2~ (L = HC{(2,6-iPr2C6H3N)(CMe)}~2~)
Kumar, S. Shravan; Singh, Sanjay; Hongjun, Fan; Roesky, Herbert W.; Vidovic, Denis; Magull, Jörg; Organometallics 23 (2004) 6327–6329; doi:10.1021/om049560n

data_4061308
_publ_section_title
;
A Planar Dimeric Six-Membered Spirane Aluminum Hydrazide:
Synthesis, X-ray Crystal Structure and Theoretical Studies
of [LAlN(Me)NH]~2~ (L = HC{(2,6-iPr2C6H3N)(CMe)}~2~)
;
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              6327
_journal_page_last               6329
_journal_paper_doi               10.1021/om049560n
_journal_volume                  23
_journal_year                    2004
_chemical_formula_sum            'C66 H104 Al2 N8'
_chemical_formula_weight         1063.53
_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                87.230(5)
_cell_angle_beta                 80.546(4)
_cell_angle_gamma                78.996(4)
_cell_formula_units_Z            1
_cell_length_a                   9.0541(5)
_cell_length_b                   13.2183(7)
_cell_length_c                   13.4469(8)
_cell_measurement_temperature    133(2)
_cell_volume                     1558.04(15)
_diffrn_ambient_temperature      133(2)
_exptl_crystal_density_diffrn    1.134
_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               4061308
Dihydridoamine and Hydridoamido Complexes of Ruthenium(II) with a Tetradentate P‒N‒N‒P Donor Ligand
Li, Tianshu; Churlaud, Raphaël; Lough, Alan J.; Abdur-Rashid, Kamaluddin; Morris, Robert H.; Organometallics 23 (2004) 6239–6247; doi:10.1021/om049565k

data_4061309
_publ_section_title
;
 Dihydridoamine and Hydridoamido Complexes of Ruthenium(II) with a Tetradentate
 P--N--N--P Donor Ligand
;
_journal_coden_ASTM              ORGND7
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              6239
_journal_page_last               6247
_journal_paper_doi               10.1021/om049565k
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety
'C44 H47 Cl N2 P2 Ru, 0.5(C H2 Cl2), 0.5(C4 H8 O)'
_chemical_formula_sum            'C46.5 H52 Cl2 N2 O0.5 P2 Ru'
_chemical_formula_weight         880.81
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_cell_angle_alpha                80.5040(15)
_cell_angle_beta                 75.3540(17)
_cell_angle_gamma                82.7670(16)
_cell_formula_units_Z            2
_cell_length_a                   11.1340(3)
_cell_length_b                   11.2830(3)
_cell_length_c                   18.6220(5)
_cell_measurement_temperature    150(1)
_cell_volume                     2223.65(10)
_diffrn_ambient_temperature      150(1)
_exptl_crystal_density_diffrn    1.316
_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_sg_symbol_Hall     'P -1'
_cod_original_formula_sum        'C46.50 H52 Cl2 N2 O0.50 P2 Ru'
_cod_database_code               4061309
Dihydridoamine and Hydridoamido Complexes of Ruthenium(II) with a Tetradentate P‒N‒N‒P Donor Ligand
Li, Tianshu; Churlaud, Raphaël; Lough, Alan J.; Abdur-Rashid, Kamaluddin; Morris, Robert H.; Organometallics 23 (2004) 6239–6247; doi:10.1021/om049565k

data_4061310
_publ_section_title
;
 Dihydridoamine and Hydridoamido Complexes of Ruthenium(II) with a Tetradentate
 P--N--N--P Donor Ligand
;
_journal_coden_ASTM              ORGND7
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              6239
_journal_page_last               6247
_journal_paper_doi               10.1021/om049565k
_journal_volume                  23
_journal_year                    2004
_chemical_formula_moiety         'C44 H46 N2 P2 Ru, C4 H8 O'
_chemical_formula_sum            'C48 H54 N2 O P2 Ru'
_chemical_formula_weight         837.94
_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                 94.899(6)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.3224(1)
_cell_length_b                   12.9914(1)
_cell_length_c                   33.9421(4)
_cell_measurement_temperature    150(1)
_cell_volume                     4095.74(7)
_diffrn_ambient_temperature      150(2)
_exptl_crystal_density_diffrn    1.359
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4061310