LMucko/crystallography-open-database huggingface dataset:
R. Lescouezec; G. Marinescu; M. C. Munoz; D. Luneau; M. Andruh; F. Lloret; J. Faus; M. Julve; J. A. Mata; R. Llusar; J. Cano; New Journal of Chemistry 25 (2001) 1224–1235; doi:10.1039/b104469a

data_7051177
_journal_issue                   10
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              1224
_journal_page_last               1235
_journal_paper_doi               10.1039/b104469a
_journal_volume                  25
_journal_year                    2001
_chemical_formula_moiety         AsPh4[Cr(dpa)(ox)2]
_chemical_formula_sum            'C38 H29 As Cr N3 O8'
_chemical_formula_weight         782.56
_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                 97.418(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   9.2221(5)
_cell_length_b                   13.471(3)
_cell_length_c                   13.8725(17)
_cell_measurement_temperature    293(2)
_cell_volume                     1709.0(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.521
_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               7051177
R. Lescouezec; G. Marinescu; M. C. Munoz; D. Luneau; M. Andruh; F. Lloret; J. Faus; M. Julve; J. A. Mata; R. Llusar; J. Cano; New Journal of Chemistry 25 (2001) 1224–1235; doi:10.1039/b104469a

data_7051178
_journal_issue                   10
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              1224
_journal_page_last               1235
_journal_paper_doi               10.1039/b104469a
_journal_volume                  25
_journal_year                    2001
_chemical_formula_moiety         'Hdpa[Cr(dpa)(ox)2] . 4H2O'
_chemical_formula_sum            'C24 H27 Cr N6 O12'
_chemical_formula_weight         643.52
_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                93.78(2)
_cell_angle_beta                 95.838(14)
_cell_angle_gamma                111.39(2)
_cell_formula_units_Z            2
_cell_length_a                   9.2942(16)
_cell_length_b                   11.380(3)
_cell_length_c                   14.292(3)
_cell_measurement_temperature    293(2)
_cell_volume                     1391.6(5)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.536
_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               7051178
R. Lescouezec; G. Marinescu; M. C. Munoz; D. Luneau; M. Andruh; F. Lloret; J. Faus; M. Julve; J. A. Mata; R. Llusar; J. Cano; New Journal of Chemistry 25 (2001) 1224–1235; doi:10.1039/b104469a

data_7051179
_journal_issue                   10
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              1224
_journal_page_last               1235
_journal_paper_doi               10.1039/b104469a
_journal_volume                  25
_journal_year                    2001
_chemical_formula_moiety         'Rad[Cr(dpa)(ox)2] . H2O'
_chemical_formula_sum            'C27 H30 Cr N6 O11'
_chemical_formula_weight         666.57
_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                 110.18(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   21.999(8)
_cell_length_b                   16.248(4)
_cell_length_c                   17.111(4)
_cell_measurement_temperature    298(2)
_cell_volume                     5741(3)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.543
_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               7051179
R. Lescouezec; G. Marinescu; M. C. Munoz; D. Luneau; M. Andruh; F. Lloret; J. Faus; M. Julve; J. A. Mata; R. Llusar; J. Cano; New Journal of Chemistry 25 (2001) 1224–1235; doi:10.1039/b104469a

data_7051180
_journal_issue                   10
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              1224
_journal_page_last               1235
_journal_paper_doi               10.1039/b104469a
_journal_volume                  25
_journal_year                    2001
_chemical_formula_moiety         'Sr[Cr(dpa)(ox)2]2 . 8H2O '
_chemical_formula_sum            'C28 H34 Cr2 N6 O24 Sr'
_chemical_formula_weight         1030.23
_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                99.95(3)
_cell_angle_beta                 99.57(3)
_cell_angle_gamma                104.87(3)
_cell_formula_units_Z            2
_cell_length_a                   9.4572(19)
_cell_length_b                   12.095(2)
_cell_length_c                   17.850(4)
_cell_measurement_temperature    293(2)
_cell_volume                     1895.5(7)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.805
_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               7051180
Crystal Engineering of Neutral N-Aryl Pyrimidinones and their HCl, HNO3 Adducts With C-H...O Supramolecular Synthon. Implications Towards Non-Linear Optics
Bagieu Beucher, M.; George, S.; Masse, R.; Muthuraman, M.; Nangia, A.; Nicoud, Jean-Francois; New Journal of Chemistry  (2001) –; doi:

data_7051191
_publ_section_title
;
Crystal Engineering of Neutral N-Aryl Pyrimidinones and their HCl,
HNO3 Adducts With C-H...O Supramolecular Synthon.  Implications Towards
Non-Linear Optics
;
_journal_name_full               'New Journal of Chemistry'
_journal_year                    2001
_chemical_formula_sum            'C18 H16 N2 O'
_chemical_formula_weight         276.34
_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                 94.37(2)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.602(2)
_cell_length_b                   10.201(3)
_cell_length_c                   23.118(6)
_cell_measurement_temperature    296.2
_cell_volume                     2963.3(11)
_diffrn_ambient_temperature      296.2
_exptl_crystal_density_diffrn    1.239
_cod_original_sg_symbol_H-M      'P 21/a'
_cod_database_code               7051191
Total synthesis of the putative structure of the marine alkaloid haliclorensin
Banwell, M.; Bray, Andrew W.; Edwards, Alison J.; Wong, David J.; New Journal of Chemistry  (2001) –; doi:

data_7051196
_publ_section_title
;
Total synthesis of the putative structure of the marine alkaloid
haliclorensin
;
_journal_name_full               'New Journal of Chemistry'
_journal_year                    2001
_chemical_formula_moiety         'C17 H25 N O '
_chemical_formula_sum            'C17 H25 N O'
_chemical_formula_weight         259.393
_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                90.00
_cell_angle_beta                 102.0894(11)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.6690(2)
_cell_length_b                   15.7588(3)
_cell_length_c                   11.4462(2)
_cell_measurement_temperature    200
_cell_volume                     1529.02(5)
_exptl_crystal_density_diffrn    1.127
_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/a'
_cod_original_formula_sum        'C17 H25 N O '
_cod_database_code               7051196
Reaction of N,N'-bis(mesityl)ethylenediamine with triethylaluminum. Formation of ten-membered aluminum amide heterocycles
Gabbai, François; Gardinier, James R.; New Journal of Chemistry 25 (2001) 1567–1571; doi:10.1039/b106488f

data_7051217
_publ_section_title
;
Reaction of N,N'-bis(mesityl)ethylenediamine with triethylaluminum.
Formation of ten-membered aluminum amide heterocycles
;
_journal_issue                   12
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              1567
_journal_page_last               1571
_journal_paper_doi               10.1039/b106488f
_journal_volume                  25
_journal_year                    2001
_chemical_formula_sum            'C54 H72 Al2 N6'
_chemical_formula_weight         859.14
_chemical_name_common
;
1,6-bis(pyridine)-1,6-diethyl-2,5,7,10-tetramesityl
-1,6-diala-2,5,7,10-tetraaza-cylodecane
;
_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                 94.0710(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.9097(6)
_cell_length_b                   16.3759(11)
_cell_length_c                   16.7141(11)
_cell_measurement_temperature    110(2)
_cell_volume                     2432.5(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.173
_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               7051217
Reaction of N,N'-bis(mesityl)ethylenediamine with triethylaluminum. Formation of ten-membered aluminum amide heterocycles
Gabbai, François; Gardinier, James R.; New Journal of Chemistry 25 (2001) 1567–1571; doi:10.1039/b106488f

data_7051218
_publ_section_title
;
Reaction of N,N'-bis(mesityl)ethylenediamine with triethylaluminum.
Formation of ten-membered aluminum amide heterocycles
;
_journal_issue                   12
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              1567
_journal_page_last               1571
_journal_paper_doi               10.1039/b106488f
_journal_volume                  25
_journal_year                    2001
_chemical_formula_sum            'C52 H78 Al2 N4 O2'
_chemical_formula_weight         845.14
_chemical_name_common
;
1,6-bis(tetrahydrofuran)-1,6-diethyl-2,5,7,10-
tetramesityl-1,6-diala-2,5,7,10-tetraaza-cylodecane
;
_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                 95.1310(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.5899(5)
_cell_length_b                   17.0806(9)
_cell_length_c                   16.3606(9)
_cell_measurement_temperature    110(2)
_cell_volume                     2390.8(2)
_diffrn_ambient_temperature      293(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               7051218
Highly peri-, regio- and diasteroselective 1,3-dipolar cycloaddition of mesitontrile oxide to 1,4-diazepines: unexpected one-step formation of a new triheterocyclic framework.
Baouid, A.; Compain, P.; Huet, Francois; Lavergne, J. P.; New Journal of Chemistry  (2001) –; doi:

data_7051227
_publ_section_title
;
Highly peri-, regio- and diasteroselective 1,3-dipolar cycloaddition
of mesitontrile oxide to 1,4-diazepines: unexpected one-step formation of a
new triheterocyclic framework.
;
_journal_name_full               'New Journal of Chemistry'
_journal_year                    2001
_chemical_formula_sum            'C33 H38 N4 O2'
_chemical_formula_weight         522.69
_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                90.000(10)
_cell_angle_beta                 101.078(3)
_cell_angle_gamma                90.000(10)
_cell_formula_units_Z            4
_cell_length_a                   22.9235(7)
_cell_length_b                   9.9309(5)
_cell_length_c                   12.8363(7)
_cell_measurement_temperature    298
_cell_volume                     2867.8(4)
_exptl_crystal_density_diffrn    1.20
_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 

The following automatic conversions were performed:

'_atom_site_thermal_displace_type' tag value 'Uij' was replaced with
'Uani' value 39 times.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7051227
Single Crystal Neutron and X-ray Diffraction Studies of (H7O3)[AuCl4]·15-crown-5.
Maria Calleja; Sax A. Mason; Paul D. Prince; Jonathan W. Steed; Clive Wilkinson; New Journal of Chemistry  (2001) –; doi:

data_7051229
_publ_section_title
;
Single Crystal Neutron and X-ray Diffraction Studies of
(H7O3)[AuCl4]&#x00B7;15-crown-5.
;
_journal_name_full               'New Journal of Chemistry'
_journal_year                    2001
_chemical_formula_sum            'C10 H27 Au Cl4 O8'
_chemical_formula_weight         614.10
_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                 104.485(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.9346(4)
_cell_length_b                   18.6728(9)
_cell_length_c                   13.9672(7)
_cell_measurement_temperature    80(2)
_cell_volume                     2003.62(17)
_diffrn_ambient_temperature      80(2)
_exptl_crystal_density_diffrn    2.036
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7051229
Single Crystal Neutron and X-ray Diffraction Studies of (H7O3)[AuCl4]·15-crown-5.
Maria Calleja; Sax A. Mason; Paul D. Prince; Jonathan W. Steed; Clive Wilkinson; New Journal of Chemistry  (2001) –; doi:

data_7051230
_publ_section_title
;
Single Crystal Neutron and X-ray Diffraction Studies of
(H7O3)[AuCl4]&#x00B7;15-crown-5.
;
_journal_name_full               'New Journal of Chemistry'
_journal_year                    2001
_chemical_formula_sum            'C10 H27 Au Cl4 O8'
_chemical_formula_weight         614.08
_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                 104.347(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.9441(7)
_cell_length_b                   18.6964(16)
_cell_length_c                   13.9886(10)
_cell_measurement_temperature    100(2)
_cell_volume                     2012.9(3)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    2.026
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7051230
Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior
Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.; New Journal of Chemistry 24 (2000) 393–398; doi:10.1039/a906582b

data_7051232
_publ_section_title
;
 Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate
 complexes of potassium and thallium. Preparation, structures and solution
 behavior
;
_journal_coden_ASTM              NJCHE5
_journal_issue                   6
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              393
_journal_page_last               398
_journal_paper_doi               10.1039/a906582b
_journal_volume                  24
_journal_year                    2000
_chemical_formula_sum            'C46 H80 B K N4 O4'
_chemical_formula_weight         803.075
_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
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   19.4597(19)
_cell_length_b                   21.273(2)
_cell_length_c                   10.8452(11)
_cell_measurement_temperature    107.
_cell_volume                     4489.6(8)
_diffrn_ambient_temperature      107.15
_exptl_crystal_density_diffrn    1.188
_cod_depositor_comments
;
The following automatic conversions were performed:

'_diffrn_ambient_temperature' value '-166.' was changed to '107.15' -
it was converted from degrees Celsius(C) to Kelvins(K).

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_original_formula_sum        'C46 H80 B1 K1 N4 O4'
_cod_database_code               7051232
Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior
Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.; New Journal of Chemistry 24 (2000) 393–398; doi:10.1039/a906582b

data_7051233
_publ_section_title
;
 Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate
 complexes of potassium and thallium. Preparation, structures and solution
 behavior
;
_journal_coden_ASTM              NJCHE5
_journal_issue                   6
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              393
_journal_page_last               398
_journal_paper_doi               10.1039/a906582b
_journal_volume                  24
_journal_year                    2000
_chemical_formula_sum            'C42 H68 B K N4 O3'
_chemical_formula_weight         726.936
_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                93.05(2)
_cell_angle_beta                 115.304(19)
_cell_angle_gamma                69.30(2)
_cell_formula_units_Z            2
_cell_length_a                   12.445(5)
_cell_length_b                   17.492(7)
_cell_length_c                   11.194(4)
_cell_measurement_temperature    103.
_cell_volume                     2046.9(15)
_diffrn_ambient_temperature      103.
_exptl_crystal_density_diffrn    1.179
_cod_original_formula_sum        'C42 H68 B1 K1 N4 O3'
_cod_database_code               7051233
Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior
Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.; New Journal of Chemistry 24 (2000) 393–398; doi:10.1039/a906582b

data_7051234
_publ_section_title
;
 Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate
 complexes of potassium and thallium. Preparation, structures and solution
 behavior
;
_journal_coden_ASTM              NJCHE5
_journal_issue                   6
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              393
_journal_page_last               398
_journal_paper_doi               10.1039/a906582b
_journal_volume                  24
_journal_year                    2000
_chemical_formula_moiety         'C30 H44 B1 N4 Tl1'
_chemical_formula_sum            'C30 H44 B N4 Tl'
_chemical_formula_weight         675.901
_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
_cell_angle_beta                 119.107(7)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   13.662(2)
_cell_length_b                   33.992(5)
_cell_length_c                   13.985(2)
_cell_measurement_temperature    109
_cell_volume                     5674.1(16)
_diffrn_ambient_temperature      109
_exptl_crystal_density_diffrn    1.582
_cod_original_sg_symbol_H-M      'P 21'
_cod_original_formula_sum        'C30 H44 B1 N4 Tl1'
_cod_database_code               7051234