LMucko/crystallography-open-database huggingface dataset:
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051284x

data_4300437
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051284x
_journal_year                    2006
_chemical_formula_sum            'C56 H48 Ag4 F12 N12 O12 S4'
_chemical_formula_weight         1868.78
_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                100.968(2)
_cell_angle_beta                 97.572(2)
_cell_angle_gamma                102.963(2)
_cell_formula_units_Z            2
_cell_length_a                   12.5520(10)
_cell_length_b                   14.0365(10)
_cell_length_c                   19.7135(16)
_cell_measurement_temperature    273(2)
_cell_volume                     3267.2(4)
_diffrn_ambient_temperature      273(2)
_exptl_crystal_density_diffrn    1.900
_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               4300437
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051286h

data_4300438
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051286h
_journal_year                    2006
_chemical_formula_moiety         'C28 H46 Co2 N8 O14 P2'
_chemical_formula_sum            'C28 H46 Co2 N8 O14 P2'
_chemical_formula_weight         898.53
_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                 99.339(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   13.3004(10)
_cell_length_b                   11.2986(9)
_cell_length_c                   12.6370(10)
_cell_measurement_temperature    100(2)
_cell_volume                     1873.9(3)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.592
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4300438
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051286h

data_4300439
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051286h
_journal_year                    2006
_chemical_formula_moiety         'C22 H21 Co N4 O4 P'
_chemical_formula_sum            'C22 H21 Co N4 O4 P'
_chemical_formula_weight         495.33
_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                71.871(8)
_cell_angle_beta                 78.973(8)
_cell_angle_gamma                86.705(8)
_cell_formula_units_Z            2
_cell_length_a                   10.1338(10)
_cell_length_b                   10.5093(10)
_cell_length_c                   11.1176(10)
_cell_measurement_temperature    100(2)
_cell_volume                     1104.46(18)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.489
_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               4300439
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051286h

data_4300440
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051286h
_journal_year                    2006
_chemical_formula_moiety         'C44 H42 Co2 N8 O8 P2'
_chemical_formula_sum            'C44 H42 Co2 N8 O8 P2'
_chemical_formula_weight         990.66
_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                 98.961(6)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.5992(7)
_cell_length_b                   23.2386(18)
_cell_length_c                   20.7890(12)
_cell_measurement_temperature    100(2)
_cell_volume                     4103.6(5)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.603
_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               4300440
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051286h

data_4300441
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051286h
_journal_year                    2006
_chemical_formula_moiety         'C18 H22 Co2 N6 O8.50 P2'
_chemical_formula_sum            'C18 H22 Co2 N6 O8.5 P2'
_chemical_formula_weight         638.22
_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                 126.80(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   28.245(4)
_cell_length_b                   11.8501(16)
_cell_length_c                   17.263(3)
_cell_measurement_temperature    100(2)
_cell_volume                     4626.3(12)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.833
_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_original_formula_sum        'C18 H22 Co2 N6 O8.50 P2'
_cod_database_code               4300441
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051286h

data_4300442
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051286h
_journal_year                    2006
_chemical_formula_moiety         'C7 H10 Co N2 O4 P'
_chemical_formula_sum            'C7 H10 Co N2 O4 P'
_chemical_formula_weight         276.07
_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                 100.432(12)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.173(2)
_cell_length_b                   5.2242(9)
_cell_length_c                   17.6690(19)
_cell_measurement_temperature    293(2)
_cell_volume                     1014.3(3)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.808
_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               4300442
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051286h

data_4300443
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051286h
_journal_year                    2006
_chemical_formula_moiety         'C9 H9 Co N2 O3 P'
_chemical_formula_sum            'C9 H9 Co N2 O3 P'
_chemical_formula_weight         283.08
_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                 94.973(13)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   24.250(3)
_cell_length_b                   9.3609(9)
_cell_length_c                   9.9408(9)
_cell_measurement_temperature    100(2)
_cell_volume                     2248.0(4)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.673
_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               4300443
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051286h

data_4300444
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051286h
_journal_year                    2006
_chemical_formula_moiety         'C9 H9 Co N2 O3 P'
_chemical_formula_sum            'C9 H9 Co N2 O3 P'
_chemical_formula_weight         283.08
_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                 91.56(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   23.535(5)
_cell_length_b                   9.1145(11)
_cell_length_c                   9.8127(19)
_cell_measurement_temperature    100(2)
_cell_volume                     2104.1(6)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.787
_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               4300444
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051289u

data_4300445
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051289u
_journal_year                    2006
_chemical_formula_sum            'C24 H54 Fe S2 Si2'
_chemical_formula_weight         518.82
_space_group_IT_number           60
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2n 2ab'
_symmetry_space_group_name_H-M   'P b c n'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   19.382(4)
_cell_length_b                   17.872(4)
_cell_length_c                   17.842(4)
_cell_measurement_temperature    293(2)
_cell_volume                     6180.4(23)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.115
_exptl_crystal_F_000             2272
_refine_ls_R_factor_obs          0.0633
_refine_ls_wR_factor_obs         0.1602
_cod_database_code               4300445
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051289u

data_4300446
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051289u
_journal_year                    2006
_chemical_formula_sum            'C32 H70 Fe O2 S2 Si2'
_chemical_formula_weight         663.03
_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                98.100(10)
_cell_angle_beta                 104.320(10)
_cell_angle_gamma                109.860(10)
_cell_formula_units_Z            2
_cell_length_a                   12.897(2)
_cell_length_b                   13.2170(10)
_cell_length_c                   13.2200(10)
_cell_measurement_temperature    293(2)
_cell_volume                     1990.1(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.106
_refine_ls_R_factor_obs          0.0494
_refine_ls_wR_factor_obs         0.1311
_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               4300446
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051289u

data_4300447
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051289u
_journal_year                    2006
_chemical_formula_sum            'C44 H94 Br3 Fe2 Na O5 S2 Si2'
_chemical_formula_weight         1197.91
_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                 90.000(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   24.363(2)
_cell_length_b                   13.3296(10)
_cell_length_c                   17.8294(14)
_cell_measurement_temperature    173(2)
_cell_volume                     5790.0(8)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.374
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4300447
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051289u

data_4300448
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051289u
_journal_year                    2006
_chemical_formula_sum            'C32 H70 Fe2 I2 O2 S2 Si2'
_chemical_formula_weight         972.68
_space_group_IT_number           33
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   31.884(6)
_cell_length_b                   9.0048(16)
_cell_length_c                   15.318(3)
_cell_measurement_temperature    173(2)
_cell_volume                     4398.0(14)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.469
_cod_database_code               4300448
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051290t

data_4300449
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051290t
_journal_year                    2006
_chemical_formula_moiety         'C28 H46 N6'
_chemical_formula_sum            'C28 H46 N6'
_chemical_formula_weight         466.71
_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                 106.571(6)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.221(2)
_cell_length_b                   14.921(2)
_cell_length_c                   18.382(2)
_cell_measurement_temperature    296.1
_cell_volume                     2949.9(7)
_exptl_crystal_density_diffrn    1.051
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4300449
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051290t

data_4300450
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051290t
_journal_year                    2006
_chemical_formula_moiety         'C31 H52 N6'
_chemical_formula_sum            'C31 H52 N6'
_chemical_formula_weight         508.79
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 94.287(9)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.777(2)
_cell_length_b                   22.315(4)
_cell_length_c                   12.774(2)
_cell_measurement_temperature    296.1
_cell_volume                     3347.7(10)
_exptl_crystal_density_diffrn    1.009
_cod_original_sg_symbol_H-M      'P 21/a'
_cod_database_code               4300450
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051290t

data_4300451
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051290t
_journal_year                    2006
_chemical_formula_moiety         'C29 H48 Cl3 Cu N6 '
_chemical_formula_sum            'C29 H48 Cl3 Cu N6'
_chemical_formula_weight         650.64
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                109.96(2)
_cell_angle_beta                 96.35(3)
_cell_angle_gamma                105.55(3)
_cell_formula_units_Z            2
_cell_length_a                   9.767(7)
_cell_length_b                   11.841(8)
_cell_length_c                   16.592(12)
_cell_measurement_temperature    212.1
_cell_volume                     1693.8(21)
_exptl_crystal_density_diffrn    1.276
_cod_original_formula_sum        'C29 H48 Cl3 Cu N6 '
_cod_database_code               4300451
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051290t

data_4300452
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051290t
_journal_year                    2006
_chemical_formula_moiety         'C28 H46 Cl Cu N6 O4 '
_chemical_formula_sum            'C28 H46 Cl Cu N6 O4'
_chemical_formula_weight         629.71
_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_Int_Tables_number      61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   18.333(9)
_cell_length_b                   15.787(8)
_cell_length_c                   22.395(11)
_cell_measurement_temperature    212.1
_cell_volume                     6481.3(54)
_exptl_crystal_density_diffrn    1.291
_cod_original_formula_sum        'C28 H46 Cl Cu N6 O4 '
_cod_database_code               4300452
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051290t

data_4300453
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051290t
_journal_year                    2006
_chemical_formula_moiety         'C31 H51 Cl2 Cu F6 N7 P '
_chemical_formula_sum            'C31 H51 Cl2 Cu F6 N7 P'
_chemical_formula_weight         801.21
_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_Int_Tables_number      61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   16.240(4)
_cell_length_b                   27.748(7)
_cell_length_c                   17.750(5)
_cell_measurement_temperature    212.1
_cell_volume                     7998.7(35)
_exptl_crystal_density_diffrn    1.331
_cod_original_formula_sum        'C31 H51 Cl2 Cu F6 N7 P '
_cod_database_code               4300453
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051290t

data_4300454
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051290t
_journal_year                    2006
_chemical_formula_moiety         'C33 H57 Cl7 Cu N7 O5 '
_chemical_formula_sum            'C33 H57 Cl7 Cu N7 O5'
_chemical_formula_weight         943.57
_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                 93.546(6)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   13.589(6)
_cell_length_b                   21.247(10)
_cell_length_c                   16.155(8)
_cell_measurement_temperature    203.1
_cell_volume                     4655.1(38)
_exptl_crystal_density_diffrn    1.346
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C33 H57 Cl7 Cu N7 O5 '
_cod_database_code               4300454
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051290t

data_4300455
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051290t
_journal_year                    2006
_chemical_formula_moiety         'C29 H46 Cu F6 N6 O P '
_chemical_formula_sum            'C29 H46 Cu F6 N6 O P'
_chemical_formula_weight         703.23
_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
_cell_angle_beta                 100.862(5)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.691(6)
_cell_length_b                   16.815(7)
_cell_length_c                   17.295(8)
_cell_measurement_temperature    294.1
_cell_volume                     3624.6(27)
_exptl_crystal_density_diffrn    1.289
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_original_formula_sum        'C29 H46 Cu F6 N6 O P '
_cod_database_code               4300455
; Inorganic Chemistry  (2006) –; doi:10.1021/ic051290t

data_4300456
_journal_name_full               'Inorganic Chemistry'
_journal_paper_doi               10.1021/ic051290t
_journal_year                    2006
_chemical_formula_moiety         'C32 H49 Cl10 Cu N6 O5 '
_chemical_formula_sum            'C32 H49 Cl10 Cu N6 O5'
_chemical_formula_weight         1015.85
_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                90.0000(8)
_cell_angle_beta                 93.6570(9)
_cell_angle_gamma                90.0000(8)
_cell_formula_units_Z            4
_cell_length_a                   15.8003(8)
_cell_length_b                   15.4502(7)
_cell_length_c                   19.3019(10)
_cell_measurement_temperature    202.1
_cell_volume                     4702.3(4)
_exptl_crystal_density_diffrn    1.435
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_original_formula_sum        'C32 H49 Cl10 Cu N6 O5 '
_cod_database_code               4300456