LMucko/crystallography-open-database huggingface dataset:
; Organometallics  (2005) –; doi:10.1021/om0501780

data_4061457
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om0501780
_journal_year                    2005
_chemical_formula_sum            'C43 H61 Cl K N3 Ni O5'
_chemical_formula_weight         833.21
_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                 115.991(6)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   21.067(6)
_cell_length_b                   11.926(4)
_cell_length_c                   19.209(6)
_cell_measurement_temperature    293(2)
_cell_volume                     4338(2)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.276
_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               4061457
; Organometallics  (2005) –; doi:10.1021/om0501780

data_4061458
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om0501780
_journal_year                    2005
_chemical_formula_sum            'C67 H91 Cl3 N6 Ni2 O10'
_chemical_formula_weight         1364.23
_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                 106.239(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   18.606(4)
_cell_length_b                   15.396(3)
_cell_length_c                   26.072(6)
_cell_measurement_temperature    117(1)
_cell_volume                     7170(3)
_diffrn_ambient_temperature      117(1)
_exptl_crystal_density_diffrn    1.264
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4061458
; Organometallics  (2005) –; doi:10.1021/om0501780

data_4061459
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om0501780
_journal_year                    2005
_chemical_formula_sum            'C42 H64 N3 Ni O4 P'
_chemical_formula_weight         764.64
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 100.884(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.306(2)
_cell_length_b                   29.396(6)
_cell_length_c                   16.036(4)
_cell_measurement_temperature    293(2)
_cell_volume                     4770.7(19)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.065
_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               4061459
; Organometallics  (2005) –; doi:10.1021/om050179s

data_4061460
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om050179s
_journal_year                    2005
_chemical_formula_sum            'C41 H49 Cl N4 Si Ti'
_chemical_formula_weight         709.28
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 92.182(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.880(3)
_cell_length_b                   19.005(4)
_cell_length_c                   17.779(4)
_cell_measurement_temperature    173(2)
_cell_volume                     4011.2(16)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.174
_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               4061460
; Organometallics  (2005) –; doi:10.1021/om050179s

data_4061461
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om050179s
_journal_year                    2005
_chemical_formula_sum            'C29 H27 Cl4 N3 Si Ti'
_chemical_formula_weight         635.33
_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                 102.342(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.100(2)
_cell_length_b                   18.062(5)
_cell_length_c                   18.337(4)
_cell_measurement_temperature    293(2)
_cell_volume                     2944.4(12)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.433
_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               4061461
; Organometallics  (2005) –; doi:10.1021/om050179s

data_4061462
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om050179s
_journal_year                    2005
_chemical_formula_sum            'C38 H41 N Si Ti'
_chemical_formula_weight         587.71
_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                 99.119(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   25.633(4)
_cell_length_b                   11.2928(17)
_cell_length_c                   22.587(4)
_cell_measurement_temperature    173(2)
_cell_volume                     6455.5(17)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.209
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               4061462
; Organometallics  (2005) –; doi:10.1021/om050179s

data_4061463
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om050179s
_journal_year                    2005
_chemical_formula_sum            'C48 H54 Cl2 N6 Si Ti'
_chemical_formula_weight         861.86
_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                 98.280(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.3148(18)
_cell_length_b                   17.191(3)
_cell_length_c                   22.176(4)
_cell_measurement_temperature    173(2)
_cell_volume                     4645.6(12)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.232
_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               4061463
; Organometallics  (2005) –; doi:10.1021/om050179s

data_4061464
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om050179s
_journal_year                    2005
_chemical_formula_sum            'C60 H72 N5 Na O3 Zr'
_chemical_formula_weight         1025.44
_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                84.293(7)
_cell_angle_beta                 86.841(5)
_cell_angle_gamma                75.727(5)
_cell_formula_units_Z            2
_cell_length_a                   11.531(4)
_cell_length_b                   17.675(6)
_cell_length_c                   17.847(6)
_cell_measurement_temperature    173(2)
_cell_volume                     3506.0(19)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    0.971
_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               4061464
; Organometallics  (2005) –; doi:10.1021/om050182b

data_4061465
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om050182b
_journal_year                    2005
_chemical_formula_sum            'C37 H54 Cl F6 N2 O P3 Ru'
_chemical_formula_weight         886.25
_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                93.125(2)
_cell_angle_beta                 105.887(2)
_cell_angle_gamma                100.942(2)
_cell_formula_units_Z            2
_cell_length_a                   10.6084(3)
_cell_length_b                   13.1357(4)
_cell_length_c                   15.0116(5)
_cell_measurement_temperature    120(2)
_cell_volume                     1962.8(1)
_diffrn_ambient_temperature      120(2)
_exptl_crystal_density_diffrn    1.500
_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               4061465
; Organometallics  (2005) –; doi:10.1021/om050182b

data_4061466
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om050182b
_journal_year                    2005
_chemical_formula_sum            'C22 H38 Cl2 N2 P2 Ru'
_chemical_formula_weight         564.45
_space_group_IT_number           2
_symmetry_cell_setting           'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                73.489(2)
_cell_angle_beta                 73.682(2)
_cell_angle_gamma                64.955(1)
_cell_formula_units_Z            2
_cell_length_a                   9.2517(3)
_cell_length_b                   10.7705(3)
_cell_length_c                   15.3802(4)
_cell_measurement_temperature    120(2)
_cell_volume                     1308.25(7)
_diffrn_ambient_temperature      120(2)
_exptl_crystal_density_diffrn    1.433
_cod_original_sg_symbol_H-M      Triclinic
_cod_database_code               4061466
Cycloheptatrienyl-Cyclopentadienlyl-Zirconium Sandwich Complexes: Structure and Bonding
Tamm, M.; Kunst, A.; Bannenberg, T.; Herdtweck, E.; Schmid, R.; Organometallics 24 (2005) 3163–3171; doi:10.1021/om050192c

data_4061467
_publ_section_title
;
Cycloheptatrienyl-Cyclopentadienlyl-Zirconium Sandwich Complexes: 
Structure and Bonding
;
_journal_issue                   13
_journal_name_full               Organometallics
_journal_page_first              3163
_journal_page_last               3171
_journal_paper_doi               10.1021/om050192c
_journal_volume                  24
_journal_year                    2005
_chemical_formula_moiety         'C12 H12 Zr'
_chemical_formula_sum            'C12 H12 Zr'
_chemical_formula_weight         247.44
_space_group_IT_number           62
_space_group_name_Hall           '-P 2ac 2n'
_space_group_name_H-M_alt        'P n m a'
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.1033(2)
_cell_length_b                   10.5715(2)
_cell_length_c                   8.2212(1)
_cell_measurement_temperature    133(1)
_cell_volume                     964.99(3)
_diffrn_ambient_temperature      133(1)
_exptl_crystal_density_diffrn    1.703
_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               4061467
Cycloheptatrienyl-Cyclopentadienlyl-Zirconium Sandwich Complexes: Structure and Bonding
Tamm, M.; Kunst, A.; Bannenberg, T.; Herdtweck, E.; Schmid, R.; Organometallics 24 (2005) 3163–3171; doi:10.1021/om050192c

data_4061468
_publ_section_title
;
Cycloheptatrienyl-Cyclopentadienlyl-Zirconium Sandwich Complexes: 
Structure and Bonding
;
_journal_issue                   13
_journal_name_full               Organometallics
_journal_page_first              3163
_journal_page_last               3171
_journal_paper_doi               10.1021/om050192c
_journal_volume                  24
_journal_year                    2005
_chemical_formula_moiety         'C17 H21 N Zr'
_chemical_formula_sum            'C17 H21 N Zr'
_chemical_formula_weight         330.57
_space_group_IT_number           57
_space_group_name_Hall           '-P 2c 2b'
_space_group_name_H-M_alt        'P b c m'
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2c 2b'
_symmetry_space_group_name_H-M   'P b c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.3304(1)
_cell_length_b                   18.5959(2)
_cell_length_c                   10.1241(1)
_cell_measurement_temperature    133(1)
_cell_volume                     1568.34(3)
_diffrn_ambient_temperature      133(1)
_exptl_crystal_density_diffrn    1.400
_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               4061468
Highly Selective Synthesis and Structural Characterization of Bis(silyl)-[3]-ferrocenophane Derivatives
Majchrzak, Mariusz; Marciniec, Bogdan; Kubicki, Maciej; Pawełczyk, Adam; Organometallics 24 (2005) 3731–3736; doi:10.1021/om050194x

data_4061469
_publ_section_title
;
Highly Selective Synthesis and Structural Characterization of 
Bis(silyl)-[3]-ferrocenophane Derivatives
;
_journal_issue                   15
_journal_name_full               Organometallics
_journal_page_first              3731
_journal_page_last               3736
_journal_paper_doi               10.1021/om050194x
_journal_volume                  24
_journal_year                    2005
_chemical_formula_moiety         'C16 H22 Fe Si2'
_chemical_formula_sum            'C16 H22 Fe Si2'
_chemical_formula_weight         326.37
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 100.660(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.7611(8)
_cell_length_b                   13.0367(10)
_cell_length_c                   12.7297(10)
_cell_measurement_temperature    110(1)
_cell_volume                     1591.9(2)
_diffrn_ambient_temperature      110(1)
_exptl_crystal_density_diffrn    1.362
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4061469
Highly Selective Synthesis and Structural Characterization of Bis(silyl)-[3]-ferrocenophane Derivatives
Majchrzak, Mariusz; Marciniec, Bogdan; Kubicki, Maciej; Pawełczyk, Adam; Organometallics 24 (2005) 3731–3736; doi:10.1021/om050194x

data_4061470
_publ_section_title
;
Highly Selective Synthesis and Structural Characterization of 
Bis(silyl)-[3]-ferrocenophane Derivatives
;
_journal_issue                   15
_journal_name_full               Organometallics
_journal_page_first              3731
_journal_page_last               3736
_journal_paper_doi               10.1021/om050194x
_journal_volume                  24
_journal_year                    2005
_chemical_formula_moiety         'C36 H30 Fe Si2'
_chemical_formula_sum            'C36 H30 Fe Si2'
_chemical_formula_weight         574.63
_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                   8.9732(9)
_cell_length_b                   14.5210(11)
_cell_length_c                   22.7141(16)
_cell_measurement_temperature    293(1)
_cell_volume                     2959.6(4)
_diffrn_ambient_temperature      293(1)
_exptl_crystal_density_diffrn    1.290
_cod_database_code               4061470
Manuel Jiménez-Tenorio; M. Dolores Palacios Tejero; M.Carmen Puerta; Pedro Valerga; Organometallics  (2005) –; doi:10.1021/om050199u

data_4061471
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om050199u
_journal_year                    2005
_chemical_formula_moiety
'C23 H46 B N8 P2 Ru 1+, C32 H12 B F24 1-; C6 H5 F'
_chemical_formula_sum            'C61 H63 B2 F25 N8 P2 Ru'
_chemical_formula_weight         1567.82
_chemical_name_common
;
[Ru(\h^5^C~5~Me~5~)(H~2~){(\K^2^-P,P')-^i^Pr~2~PNHCH~2~CH~2~NHP^i^Pr~2~}]
[B{(C~6~H~3~(CF~3~)~2~}~4~].C~6~H~5~F
;
_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                86.926(2)
_cell_angle_beta                 79.169(2)
_cell_angle_gamma                87.394(2)
_cell_formula_units_Z            2
_cell_length_a                   12.6791(13)
_cell_length_b                   14.0536(13)
_cell_length_c                   19.250(2)
_cell_measurement_temperature    100(2)
_cell_volume                     3361.9(6)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.549
_cod_database_code               4061471
Manuel Jiménez-Tenorio; M. Dolores Palacios Tejero; M.Carmen Puerta; Pedro Valerga; Organometallics  (2005) –; doi:10.1021/om050199u

data_4061472
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om050199u
_journal_year                    2005
_chemical_formula_moiety         'C23 H44 B N10 P2 Ru 1+; C32 H12 B F24 1-'
_chemical_formula_sum            'C55 H56 B2 F24 N10 P2 Ru'
_chemical_formula_weight         1497.73
_chemical_name_common
;
[Ru(\h^5^C~5~Me~5~)(N~2~){(\K^2^-P,P')-^i^Pr~2~PNHCH~2~CH~2~NHP^i^Pr~2~}]
[B{(C~6~H~3~(CF~3~)~2~}~4~]
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 108.191(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   19.0967(15)
_cell_length_b                   18.5933(15)
_cell_length_c                   18.3316(15)
_cell_measurement_temperature    100(2)
_cell_volume                     6183.7(9)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.609
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4061472
Square Planar versus Tetrahedral NiS~4~ Cores in the Coordination Spheres of (HMB)Ru(II) and Cp*Ru(III) and a related CuS~4~ Complex. Synthetic, Single Crystal X-ray Diffraction and Magnetic Studies {HMB = η^6^-C~6~Me~6~ and Cp* = η^5^-C~5~Me~5~}
Shin, Richard Y. C.; Teo, Ming Ern; Tan, Geok Kheng; Koh, Lip Lin; Vittal, Jagadese J.; Goh, Lai Yoong; Murray, Keith S.; Moubaraki, Boujemaa; Zhou, X.-Y.; Organometallics 24 (2005) 4265–4273; doi:10.1021/om050200p

data_4061473
_publ_section_title
;
Square Planar versus Tetrahedral NiS~4~ Cores in the Coordination Spheres 
of (HMB)Ru(II) and Cp*Ru(III) and a related CuS~4~ Complex. Synthetic, 
Single Crystal X-ray Diffraction and Magnetic Studies {HMB = \h^6^-C~6~Me~6~ 
and Cp* = \h^5^-C~5~Me~5~}
;
_journal_issue                   17
_journal_name_full               Organometallics
_journal_page_first              4265
_journal_page_last               4273
_journal_paper_doi               10.1021/om050200p
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C38 H64 F12 Ni O2 P2 Ru2 S6'
_chemical_formula_weight         1296.04
_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                81.386(4)
_cell_angle_beta                 70.138(4)
_cell_angle_gamma                76.824(4)
_cell_formula_units_Z            1
_cell_length_a                   10.1593(18)
_cell_length_b                   10.5154(19)
_cell_length_c                   12.654(2)
_cell_measurement_temperature    294(2)
_cell_volume                     1234.1(4)
_diffrn_ambient_temperature      294(2)
_exptl_crystal_density_diffrn    1.744
_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               4061473