LMucko/crystallography-open-database huggingface dataset:
; Journal of the American Chemical Society  (2005) –; doi:

data_4100729
_journal_name_full               'Journal of the American Chemical Society'
_journal_year                    2005
_chemical_formula_moiety         ' C36 H46 N2 O9, C18 H31 N2 O, Cl'
_chemical_formula_sum            'C54 H77 Cl N4 O10'
_chemical_formula_weight         977.68
_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                 100.9476(5)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.03740(10)
_cell_length_b                   21.5071(3)
_cell_length_c                   22.7595(3)
_cell_measurement_temperature    150
_cell_volume                     5304.38(11)
_diffrn_ambient_temperature      150
_exptl_crystal_density_diffrn    1.224
_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_original_formula_sum        ' C54 H77 Cl N4 O10 '
_cod_database_code               4100729
; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja050281g

data_4100730
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja050281g
_journal_year                    2005
_chemical_formula_sum            'H5 In7 Na5 O6 P0 S13'
_chemical_formula_weight         1436.51
_space_group_IT_number           219
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'F -4a 2 3'
_symmetry_space_group_name_H-M   'F -4 3 c'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   18.2136(13)
_cell_length_b                   18.2136(13)
_cell_length_c                   18.2136(13)
_cell_measurement_temperature    233(2)
_cell_volume                     6042.1(7)
_diffrn_ambient_temperature      233(2)
_exptl_crystal_density_diffrn    3.158
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Cubic' changed to 'cubic' 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               4100730
Chelate and pincer carbene complexes of rhodium and platinum derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
Kubo, Kazuyuki; Jones, Nathan D.; Ferguson, Michael J.; McDonald, Robert; Cavell, Ronald G.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja0502831

data_4100731
_publ_section_title
;
Chelate and pincer carbene complexes of rhodium and platinum
 derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja0502831
_journal_year                    2005
_chemical_formula_moiety         'C45 H41 P2 Rh, 2.5(C6 H6)'
_chemical_formula_sum            'C60 H56 P2 Rh'
_chemical_formula_weight         941.90
_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                 93.0864(12)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.3600(8)
_cell_length_b                   13.2216(9)
_cell_length_c                   28.7939(19)
_cell_measurement_temperature    193(2)
_cell_volume                     4698.6(5)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.331
_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               4100731
Chelate and pincer carbene complexes of rhodium and platinum derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
Kubo, Kazuyuki; Jones, Nathan D.; Ferguson, Michael J.; McDonald, Robert; Cavell, Ronald G.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja0502831

data_4100732
_publ_section_title
;
Chelate and pincer carbene complexes of rhodium and platinum
 derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja0502831
_journal_year                    2005
_chemical_formula_moiety         'C43 H47 P4 Rh'
_chemical_formula_sum            'C43 H47 P4 Rh'
_chemical_formula_weight         790.60
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 91.107(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.479(3)
_cell_length_b                   19.374(5)
_cell_length_c                   17.234(5)
_cell_measurement_temperature    193(2)
_cell_volume                     3832.1(17)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.370
_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               4100732
Chelate and pincer carbene complexes of rhodium and platinum derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
Kubo, Kazuyuki; Jones, Nathan D.; Ferguson, Michael J.; McDonald, Robert; Cavell, Ronald G.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja050361k

data_4100733
_publ_section_title
;
Chelate and pincer carbene complexes of rhodium and platinum
 derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja050361k
_journal_year                    2005
_chemical_formula_moiety         'C22 H52 N2 P2 Ru Si2'
_chemical_formula_sum            'C22 H52 N2 P2 Ru Si2'
_chemical_formula_weight         563.85
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.313(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.3614(8)
_cell_length_b                   14.4508(7)
_cell_length_c                   17.8885(11)
_cell_measurement_temperature    150(2)
_cell_volume                     2936.9(3)
_diffrn_ambient_temperature      150(2)
_exptl_crystal_density_diffrn    1.275
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               4100733
Chelate and pincer carbene complexes of rhodium and platinum derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
Kubo, Kazuyuki; Jones, Nathan D.; Ferguson, Michael J.; McDonald, Robert; Cavell, Ronald G.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja050543e

data_4100734
_publ_section_title
;
Chelate and pincer carbene complexes of rhodium and platinum
  derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja050543e
_journal_year                    2005
_chemical_formula_sum            'C9 H10 B F3 N0 O2'
_chemical_formula_weight         217.98
_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                 95.540(6)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.947(2)
_cell_length_b                   12.591(3)
_cell_length_c                   7.808(2)
_cell_measurement_temperature    193(2)
_cell_volume                     973.3(4)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.488
_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               4100734
Chelate and pincer carbene complexes of rhodium and platinum derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
Kubo, Kazuyuki; Jones, Nathan D.; Ferguson, Michael J.; McDonald, Robert; Cavell, Ronald G.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja050543e

data_4100735
_publ_section_title
;
Chelate and pincer carbene complexes of rhodium and platinum
  derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja050543e
_journal_year                    2005
_chemical_formula_sum            'C8 H7 B F3 N O3'
_chemical_formula_weight         232.96
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 92.890(6)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   6.0180(18)
_cell_length_b                   14.640(4)
_cell_length_c                   11.003(3)
_cell_measurement_temperature    193(2)
_cell_volume                     968.2(5)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.598
_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               4100735
Chelate and pincer carbene complexes of rhodium and platinum derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
Kubo, Kazuyuki; Jones, Nathan D.; Ferguson, Michael J.; McDonald, Robert; Cavell, Ronald G.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja050830i

data_4100736
_publ_section_title
;
Chelate and pincer carbene complexes of rhodium and platinum
  derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja050830i
_journal_year                    2005
_chemical_formula_sum            'C14 H19 Cl6 O3 Sb'
_chemical_formula_weight         569.74
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   17.998(3)
_cell_length_b                   13.063(2)
_cell_length_c                   18.084(3)
_cell_measurement_temperature    163(2)
_cell_volume                     4251.7(11)
_diffrn_ambient_temperature      163(2)
_exptl_crystal_density_diffrn    1.780
_exptl_crystal_density_meas      ?
_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 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'n/a' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_database_code               4100736
Chelate and pincer carbene complexes of rhodium and platinum derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
Kubo, Kazuyuki; Jones, Nathan D.; Ferguson, Michael J.; McDonald, Robert; Cavell, Ronald G.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja050830i

data_4100737
_publ_section_title
;
Chelate and pincer carbene complexes of rhodium and platinum
  derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja050830i
_journal_year                    2005
_chemical_formula_sum            'C14 H25 Cl6 O4 Sb'
_chemical_formula_weight         591.79
_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                 97.015(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.4080(19)
_cell_length_b                   12.304(2)
_cell_length_c                   18.297(3)
_cell_measurement_temperature    208(2)
_cell_volume                     2325.5(7)
_diffrn_ambient_temperature      208(2)
_exptl_crystal_density_diffrn    1.690
_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               4100737
He, Xuyang; Allan, John F.; Noll, Bruce C.; Henderson, Kenneth W.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja051050c

data_4100738
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja051050c
_journal_year                    2005
_chemical_formula_moiety         'C24 H46 Ca N4 O Si2'
_chemical_formula_sum            'C24 H46 Ca N4 O Si2'
_chemical_formula_weight         502.91
_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                 99.5875(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.8085(2)
_cell_length_b                   30.7978(7)
_cell_length_c                   10.1626(2)
_cell_measurement_temperature    100(2)
_cell_volume                     3027.04(11)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.104
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4100738
He, Xuyang; Allan, John F.; Noll, Bruce C.; Henderson, Kenneth W.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja051050c

data_4100739
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja051050c
_journal_year                    2005
_chemical_formula_moiety
'C51 H75 O9 Ca2, C18 H54 N3 Si6 Ca, 1.40(C4 H8 O), 0.30(C6 H14)'
_chemical_formula_sum            'C76.4 H144.39 Ca3 N3 O10.39 Si6'
_chemical_formula_weight         1560.16
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 103.381(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   22.1186(3)
_cell_length_b                   17.4676(3)
_cell_length_c                   24.4576(4)
_cell_measurement_temperature    100(2)
_cell_volume                     9192.9(3)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.127
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C76.40 H144.39 Ca3 N3 O10.39 Si6'
_cod_database_code               4100739
He, Xuyang; Allan, John F.; Noll, Bruce C.; Henderson, Kenneth W.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja051050c

data_4100740
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja051050c
_journal_year                    2005
_chemical_formula_moiety
'C16 H32 K O7 1+, C18 H54 Ca N3 Si6 1-, C7 H8'
_chemical_formula_sum            'C41 H94 Ca K N3 O7 Si6'
_chemical_formula_weight         988.91
_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                 93.785(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.2210(3)
_cell_length_b                   30.8573(7)
_cell_length_c                   15.7275(4)
_cell_measurement_temperature    100(2)
_cell_volume                     5918.0(2)
_diffrn_ambient_temperature      100(2)
_diffrn_source_type              'Siemens KFFMO2K-90'
_exptl_crystal_density_diffrn    1.110
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4100740
He, Xuyang; Allan, John F.; Noll, Bruce C.; Henderson, Kenneth W.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja051050c

data_4100741
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja051050c
_journal_year                    2005
_chemical_formula_moiety         'C38 H70 Mg2 N2 O4 Si4'
_chemical_formula_sum            'C38 H70 Mg2 N2 O4 Si4'
_chemical_formula_weight         779.94
_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                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.422(3)
_cell_length_b                   17.076(2)
_cell_length_c                   15.536(2)
_cell_measurement_temperature    123(2)
_cell_volume                     4622.2(11)
_diffrn_ambient_temperature      123(2)
_exptl_crystal_density_diffrn    1.121
_cod_database_code               4100741
He, Xuyang; Allan, John F.; Noll, Bruce C.; Henderson, Kenneth W.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja0510616

data_4100742
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja0510616
_journal_year                    2005
_chemical_formula_sum            'C46.5 H66 N2 O9 S Si'
_chemical_formula_weight         857.16
_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                64.694(3)
_cell_angle_beta                 88.776(5)
_cell_angle_gamma                89.879(5)
_cell_formula_units_Z            2
_cell_length_a                   10.6540(18)
_cell_length_b                   14.514(3)
_cell_length_c                   16.899(3)
_cell_measurement_temperature    193(2)
_cell_volume                     2361.8(7)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.205
_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        'C46.50 H66 N2 O9 S Si'
_cod_database_code               4100742
Zhang, Liming; Kozmin, Sergey A.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja051110e

data_4100743
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja051110e
_journal_year                    2005
_chemical_formula_sum            'C38 H48 O8'
_chemical_formula_weight         632.76
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.069(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.124(2)
_cell_length_b                   12.920(3)
_cell_length_c                   15.721(4)
_cell_measurement_temperature    100(2)
_cell_volume                     1650.0(7)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    1.274
_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'
_cod_database_code               4100743
Zhang, Liming; Kozmin, Sergey A.; Journal of the American Chemical Society  (2005) –; doi:10.1021/ja051814o

data_4100744
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja051814o
_journal_year                    2005
_chemical_formula_sum            'C27 H63 Al Si3'
_chemical_formula_weight         499.02
_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                 124.561(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.0610(3)
_cell_length_b                   31.4300(14)
_cell_length_c                   14.4160(6)
_cell_measurement_temperature    120
_cell_volume                     3381.0(2)
_diffrn_ambient_temperature      120
_exptl_crystal_density_diffrn    0.980
_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               4100744