LMucko/crystallography-open-database huggingface dataset:
Crystal structure of diethylenetriamine-penta[zinc(II),cobalt(II)] tetraphosphate, (C~4~H~14~N~3~)(Zn~4.04~Co~0.96~)(PO~4~)~4~
Wang, Yi-Fei; Lin, Feng; Pang, Wei-Qin; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 387–388; doi:

data_8100174
_publ_section_title
;
Crystal structure of diethylenetriamine-penta[zinc(II),cobalt(II)] 
tetraphosphate, (C~4~H~14~N~3~)(Zn~4.04~Co~0.96~)(PO~4~)~4~
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              387
_journal_page_last               388
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C4 H14 Co N3 O16 P4 Zn4'
_chemical_formula_weight         810.91
_space_group_IT_number           9
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 130.28(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   27.037(5)
_cell_length_b                   5.2070(10)
_cell_length_c                   17.893(4)
_cell_measurement_temperature    293(2)
_cell_volume                     1921.9(7)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    2.803
_cod_original_sg_symbol_H-M      'C c'
_cod_original_formula_sum        'C4 H14 Co1 N3 O16 P4 Zn4'
_cod_database_code               8100174
Crystal structure of catena-bis(μ-4-nitrophenolato)lead(II), Pb(C~6~H~4~NO~3~)~2~
Chen, Zhong-Xi; Xia, Fu-Jun; Zhu, Nan-Wen; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 385–386; doi:

data_8100175
_publ_section_title
;
Crystal structure of catena-bis(\m-4-nitrophenolato)lead(II), 
Pb(C~6~H~4~NO~3~)~2~
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              385
_journal_page_last               386
_journal_volume                  219
_journal_year                    2004
_chemical_formula_moiety         'C12 H8 N2 O6 Pb'
_chemical_formula_sum            'C12 H8 N2 O6 Pb'
_chemical_formula_weight         483.39
_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                 92.908(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   15.1153(12)
_cell_length_b                   15.3621(13)
_cell_length_c                   6.8134(5)
_cell_measurement_temperature    298(2)
_cell_volume                     1580.1(2)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    2.032
_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_Hall     -C2yc
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               8100175
Crystal structure of 3,4-difluoro-1H-pyrrole, C~4~H~3~F~2~N
Leroy, Jacques; Bondon, Arnaud; Toupet, Loic; Meerschaut, Alain; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 389–390; doi:

data_8100176
_publ_section_title
;
Crystal structure of 3,4-difluoro-1H-pyrrole, C~4~H~3~F~2~N
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              389
_journal_page_last               390
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C4 H3 F2 N'
_chemical_formula_weight         103.07
_chemical_melting_point          434.1(10)
_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                   5.5515(11)
_cell_length_b                   11.017(2)
_cell_length_c                   13.597(3)
_cell_measurement_temperature    120(1)
_cell_volume                     831.6(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.646
_cod_depositor_comments
;
The following automatic conversions were performed:

'_chemical_melting_point' value '160-162 \%C' was changed to
'434.1(10)' - it was converted from degrees Celsius(C) to Kelvins(K),
the average value was taken and precision was estimated.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_database_code               8100176
Crystal structure of bis(3,4,5,6-tetrahydropyrimidine-2(1H)-thione- S)gold(I) chloride, [Au(C~4~H~8~N~2~S)~2~]Cl
Fettouhi, Mohammed; Isab, Anvarhusein A.; Wazeer, Mohamed I. M.; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 391–392; doi:

data_8100177
_publ_section_title
;
Crystal structure of bis(3,4,5,6-tetrahydropyrimidine-2(1H)-thione-
S)gold(I) chloride, [Au(C~4~H~8~N~2~S)~2~]Cl
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              391
_journal_page_last               392
_journal_volume                  219
_journal_year                    2004
_chemical_formula_moiety         '(C8 H16 AuN4 S2)^+^, Cl^-^'
_chemical_formula_sum            'C8 H16 Au Cl N4 S2'
_chemical_formula_weight         464.78
_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            4
_cell_length_a                   11.9055(12)
_cell_length_b                   11.7507(11)
_cell_length_c                   10.0615(10)
_cell_measurement_temperature    294
_cell_volume                     1407.6(2)
_diffrn_ambient_temperature      294
_exptl_crystal_density_diffrn    2.193
_cod_original_formula_sum        'C8 H16 Au1 Cl1 N4 S2'
_cod_database_code               8100177
Crystal structure of (carbonato-O,O')bis(1,10-phenanthroline-N,N') cobalt(II) heptahydrate, [Co(C~12~H~8~N~2~)~2~CO~3~] · 7H~2~O
Li, Rong-Sheng; Lin, Jian-Li; Zheng, Yue-Qing; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 425–426; doi:

data_8100178
_publ_section_title
;
Crystal structure of (carbonato-O,O')bis(1,10-phenanthroline-N,N')
cobalt(II) heptahydrate, [Co(C~12~H~8~N~2~)~2~CO~3~] &#x00B7; 7H~2~O
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              425
_journal_page_last               426
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C25 H30 Co N4 O10'
_chemical_formula_weight         605.46
_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                 105.72(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.949(2)
_cell_length_b                   26.441(5)
_cell_length_c                   10.578(2)
_cell_measurement_temperature    293(2)
_cell_volume                     2678.6(9)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.501
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               8100178
Crystal structure of (1S,6S)-8-benzyl-7,9-dioxo-8-aza-2-azoniabicyclo [4,3,0]-nonane (2S,3S)-(-)-hydrogen tartrate dihydrate, (C~4~H~5~N~2~O~10~) (C~14~H~17~O~2~) · 2H~2~O, a chiral inclusion
Chen, Fan; Hu, Mao-Lin; Wang, Shun; Wu, Hua-Yue; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 417–418; doi:

data_8100179
_publ_section_title
;
Crystal structure of (1S,6S)-8-benzyl-7,9-dioxo-8-aza-2-azoniabicyclo
[4,3,0]-nonane (2S,3S)-(-)-hydrogen tartrate dihydrate, (C~4~H~5~N~2~O~10~)
(C~14~H~17~O~2~) &#x00B7; 2H~2~O, a chiral inclusion
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              417
_journal_page_last               418
_journal_volume                  219
_journal_year                    2004
_chemical_formula_moiety         'C14 H17 N2 O2, C4 H5 O6, 2(H2 O)'
_chemical_formula_sum            'C18 H26 N2 O10'
_chemical_formula_weight         430.41
_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                   7.0751(6)
_cell_length_b                   11.3427(8)
_cell_length_c                   26.268(2)
_cell_measurement_temperature    298(2)
_cell_volume                     2108.0(3)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.356
_cod_original_sg_symbol_Hall     P2ac2ab
_cod_database_code               8100179
Crystal structure of tris(ethylendiamine-N,N')cobalt(III) hexafluorogallate, Co(C~2~H~8~N~2~)~3~[GaF~6~]
Loiseau, Thierry; Serpaggi, Fabien; Ferey, Gérard; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 469–470; doi:

data_8100180
_publ_section_title
;
Crystal structure of tris(ethylendiamine-N,N')cobalt(III) hexafluorogallate, 
Co(C~2~H~8~N~2~)~3~[GaF~6~]
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              469
_journal_page_last               470
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C6 H24 Co F6 Ga N6'
_chemical_formula_weight         422.96
_space_group_IT_number           182
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  'P 6c 2c'
_symmetry_space_group_name_H-M   'P 63 2 2'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            2
_cell_length_a                   8.95940(10)
_cell_length_b                   8.95940(10)
_cell_length_c                   9.5448(2)
_cell_measurement_temperature    293(2)
_cell_volume                     663.522(17)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    2.117
_cod_database_code               8100180
Crystal structure of catena-poly[μ-tris(2,3-dimethoxybenzoato) lanthanum(III)], La(C~9~H~9~O~4~)~3~
Li, Xia; Zou, Ying-Quan; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 421–422; doi:

data_8100181
_publ_section_title
;
Crystal structure of catena-poly[\m-tris(2,3-dimethoxybenzoato)
lanthanum(III)], La(C~9~H~9~O~4~)~3~
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              421
_journal_page_last               422
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C27 H27 La O12'
_chemical_formula_weight         682.40
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.213(3)
_cell_length_b                   17.274(6)
_cell_length_c                   18.960(6)
_cell_measurement_temperature    293(2)
_cell_volume                     2689.7(16)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.685
_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               8100181
Crystal structure of chlorobis(η^5^-pentamethylcyclopentadienyl) (η^3^-2-methyl-2-propenyl)zirconium, Zr(C~4~H~7~)(C~10~H~15~) ~2~Cl
Ernst, Richard D.; Harvey, Benjamin G.; Arif, Atta M.; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 401–402; doi:

data_8100182
_publ_section_title
;
Crystal structure of chlorobis(\h^5^-pentamethylcyclopentadienyl)
(\h^3^-2-methyl-2-propenyl)zirconium, Zr(C~4~H~7~)(C~10~H~15~)
~2~Cl
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              401
_journal_page_last               402
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C24 H37 Cl Zr'
_chemical_formula_weight         452.21
_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                77.5549(6)
_cell_angle_beta                 80.6252(7)
_cell_angle_gamma                70.8162(7)
_cell_formula_units_Z            2
_cell_length_a                   8.76500(10)
_cell_length_b                   9.32780(10)
_cell_length_c                   15.3642(2)
_cell_measurement_temperature    150(1)
_cell_volume                     1152.73(2)
_diffrn_ambient_temperature      150(1)
_exptl_crystal_density_diffrn    1.303
_cod_database_code               8100182
Crystal structure of di(n-butyl)bis(η^5^-pentamethylcyclopentadienyl) zirconium, Zr(C~4~H~9~)~2~(C~10~H~15~)~2~
Ernst, Richard D.; Harvey, Benjamin G.; Arif, Atta M.; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 398–400; doi:

data_8100183
_publ_section_title
;
Crystal structure of di(n-butyl)bis(\h^5^-pentamethylcyclopentadienyl)
zirconium, Zr(C~4~H~9~)~2~(C~10~H~15~)~2~
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              398
_journal_page_last               400
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C28 H48 Zr'
_chemical_formula_weight         475.88
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   17.1538(3)
_cell_length_b                   17.2598(3)
_cell_length_c                   17.3568(2)
_cell_measurement_temperature    150(1)
_cell_volume                     5138.85(14)
_diffrn_ambient_temperature      150(1)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_exptl_crystal_density_diffrn    1.230
_cod_database_code               8100183
Crystal structure of 3-(2-chlorobenzoyl)-1,1-diphenylthiourea, (C~6~H~5~) ~2~N(CS)(NH)(CO)(C~6~H~4~Cl)
Binzet, Gün; Flörke, Ulrich; Külcü, Nevzat; Arslan, Hakan; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 395–397; doi:

data_8100184
_publ_section_title
;
Crystal structure of 3-(2-chlorobenzoyl)-1,1-diphenylthiourea, (C~6~H~5~)
~2~N(CS)(NH)(CO)(C~6~H~4~Cl)
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              395
_journal_page_last               397
_journal_volume                  219
_journal_year                    2004
_chemical_formula_moiety         'C20 H15 Cl N2 O S'
_chemical_formula_sum            'C20 H15 Cl N2 O S'
_chemical_formula_weight         366.85
_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                85.568(2)
_cell_angle_beta                 70.610(2)
_cell_angle_gamma                82.639(2)
_cell_formula_units_Z            4
_cell_length_a                   9.9962(8)
_cell_length_b                   12.9112(11)
_cell_length_c                   14.6704(13)
_cell_measurement_temperature    173(2)
_cell_volume                     1770.1(3)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.377
_cod_original_formula_sum        'C20 H15 Cl N2 O1 S1'
_cod_database_code               8100184
Crystal structures of (di-2-pyridyl ketone)zinc dibromide and diiodide, Zn(C~11~H~8~N~2~O)X~2~ (X = Br, I)
Kanaras, Christina; Westcott, Barry L.; Crundwell, Guy; Updegraff, III, James B.; Zeller, Matthias; Hunter, Allen D.; Sommerer, Shaun O.; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 393–394; doi:

data_8100185
_publ_section_title
;
Crystal structures of (di-2-pyridyl ketone)zinc dibromide and diiodide, 
Zn(C~11~H~8~N~2~O)X~2~ (X = Br, I)
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              393
_journal_page_last               394
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C11 H8 Br2 N2 O Zn'
_chemical_formula_weight         409.38
_chemical_name_common
;
zinc di-2-pyridyl ketone bromide
;
_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                 103.229(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.300(2)
_cell_length_b                   8.0699(16)
_cell_length_c                   12.751(3)
_cell_measurement_temperature    100(2)
_cell_volume                     1232.1(4)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    2.207
_cod_depositor_comments
;
The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'NO' changed to 'no' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (27 times).

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               8100185
Crystal structures of (di-2-pyridyl ketone)zinc dibromide and diiodide, Zn(C~11~H~8~N~2~O)X~2~ (X = Br, I)
Kanaras, Christina; Westcott, Barry L.; Crundwell, Guy; Updegraff, III, James B.; Zeller, Matthias; Hunter, Allen D.; Sommerer, Shaun O.; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 393–394; doi:

data_8100186
_publ_section_title
;
Crystal structures of (di-2-pyridyl ketone)zinc dibromide and diiodide, 
Zn(C~11~H~8~N~2~O)X~2~ (X = Br, I)
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              393
_journal_page_last               394
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C11 H8 I2 N2 O Zn'
_chemical_formula_weight         503.36
_chemical_name_common
;
zinc di-2-pyridyl ketone iodide
;
_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                 103.6490(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.6266(5)
_cell_length_b                   8.3959(3)
_cell_length_c                   13.1079(5)
_cell_measurement_temperature    100(2)
_cell_volume                     1350.35(9)
_diffrn_ambient_temperature      100(2)
_exptl_crystal_density_diffrn    2.476
_cod_depositor_comments
;
The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'NO' changed to 'no' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (27 times).

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               8100186
Crystal structure of 1,4-bis(4,4-dimethylcyclohexa-2,5-dienylidene)- N,N',N'',N'''-tetra-o-tolyl-but-2-ene-1,2,3,4-tetraamine, (C~24~H~22~N~2~) ~2~
Ernst, Richard D.; Basta, Rehan; Arif, Atta M.; Zeitschrift für Kristallographie - New Crystal Structures 219 (2004) 403–404; doi:

data_8100187
_publ_section_title
;
Crystal structure of 1,4-bis(4,4-dimethylcyclohexa-2,5-dienylidene)-
N,N',N'',N'''-tetra-o-tolyl-but-2-ene-1,2,3,4-tetraamine, (C~24~H~22~N~2~)
~2~
;
_journal_issue                   4
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              403
_journal_page_last               404
_journal_volume                  219
_journal_year                    2004
_chemical_formula_sum            'C48 H52 N4'
_chemical_formula_weight         684.94
_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                63.2758(17)
_cell_angle_beta                 73.8274(15)
_cell_angle_gamma                82.6352(13)
_cell_formula_units_Z            1
_cell_length_a                   9.6328(2)
_cell_length_b                   10.8348(3)
_cell_length_c                   10.9423(3)
_cell_measurement_temperature    150(1)
_cell_volume                     979.68(4)
_diffrn_ambient_temperature      150(1)
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.990
_exptl_crystal_density_diffrn    1.161
_refine_diff_density_rms         0.036
_cod_database_code               8100187