LMucko/crystallography-open-database huggingface dataset:
Crystal structure of diaqua-bis[N-(2-pyridyl)carbonyl- aniline]copper (II) diperchlorate, Cu(C~12~H~16~N~2~O)~2~(H~2~O)~2~(ClO~4~)~2~, at 120K
Ramazani, Ali; Morsali, Ali; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 299–300; doi:

data_8100368
_publ_section_title
;
Crystal structure of diaqua-bis[N-(2-pyridyl)carbonyl- aniline]copper
(II) diperchlorate, Cu(C~12~H~16~N~2~O)~2~(H~2~O)~2~(ClO~4~)~2~, at 
120K
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              299
_journal_page_last               300
_journal_volume                  218
_journal_year                    2003
_chemical_formula_moiety         'C24 H24 Cu N4 O4 2+, (Cl O4 1-)2'
_chemical_formula_structural     'Cu(C12 H16 N2 O)2 (H2 O)2 (Cl O4)2'
_chemical_formula_sum            'C24 H24 Cl2 Cu N4 O12'
_chemical_formula_weight         694.91
_chemical_melting_point          225
_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                 104.927(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.2448(17)
_cell_length_b                   11.852(2)
_cell_length_c                   14.882(3)
_cell_measurement_temperature    120(2)
_cell_volume                     1405.1(5)
_diffrn_ambient_temperature      120(2)
_exptl_crystal_density_diffrn    1.642
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               8100368
Crystal structure of tetra-n-butylammonium (1,3-dithiol-2-thione-4, 5-dithiolato)-(diethyl-dithiocarbamato-S,S')nickelate(II), (C~16~H~36~N) (C~8~H~10~NNiS~7~)
Xu, Wen; Yu, Wen-Tao; Xue, Gang; Fang, Qi; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 325–327; doi:

data_8100369
_publ_section_title
;
Crystal structure of tetra-n-butylammonium (1,3-dithiol-2-thione-4,
5-dithiolato)-(diethyl-dithiocarbamato-S,S')nickelate(II), (C~16~H~36~N)
(C~8~H~10~NNiS~7~)
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              325
_journal_page_last               327
_journal_volume                  218
_journal_year                    2003
_chemical_formula_moiety         'C16 H36 N, C8 H10 N Ni S7'
_chemical_formula_structural     '(C16 H36 N)(C8 H10 N Ni S7)'
_chemical_formula_sum            'C24 H46 N2 Ni S7'
_chemical_formula_weight         645.81
_chemical_melting_point          425
_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                 95.119(11)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.8459(16)
_cell_length_b                   24.702(6)
_cell_length_c                   15.392(3)
_cell_measurement_temperature    293(2)
_cell_volume                     3350.0(12)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.280
_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:

'_chemical_melting_point' value '425K' was changed to '425' - the
value should be numeric and without a unit designator.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_original_sg_symbol_H-M      'C c'
_cod_original_formula_sum        'C24 H46 N2 Ni1 S7'
_cod_database_code               8100369
Crystal structure of 1,2-ethylenediaminesilver(I) bis(4-nitrobenzoato) silver(I), C~16~H~16~Ag~2~N~4~O~8~
Zhu, Hai-Liang; Pan, Yong-Jun; Wang, Xian-Jiang; Wang, Da-Qi; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 301–302; doi:

data_8100370
_publ_section_title
;
Crystal structure of 1,2-ethylenediaminesilver(I) bis(4-nitrobenzoato)
silver(I), C~16~H~16~Ag~2~N~4~O~8~
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              301
_journal_page_last               302
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'C16 H16 Ag2 N4 O8'
_chemical_formula_sum            'C16 H16 Ag2 N4 O8'
_chemical_formula_weight         608.07
_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                82.638(7)
_cell_angle_beta                 83.169(6)
_cell_angle_gamma                67.880(6)
_cell_formula_units_Z            2
_cell_length_a                   6.346(3)
_cell_length_b                   7.022(3)
_cell_length_c                   23.044(11)
_cell_measurement_temperature    298(2)
_cell_volume                     940.5(8)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    2.147
_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               8100370
Crystal structure of 1,2-diaminopropanesilver(I) 3,5-dinitro- benzoate hydrate, Ag(C~3~H~10~N~2~)(C~7~H~3~N~2~O~6~) ·~ ~1.5H~2~O
Zhu, Hai-Liang; Wang, Xian-Jiang; Pan, Yong-Jun; Wang, Da-Qi; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 303–304; doi:

data_8100371
_publ_section_title
;
Crystal structure of 1,2-diaminopropanesilver(I) 3,5-dinitro- benzoate 
hydrate, Ag(C~3~H~10~N~2~)(C~7~H~3~N~2~O~6~) &#x00B7;~ ~1.5H~2~O
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              303
_journal_page_last               304
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'Ag(C7 H3 N2 O6)(C3 H10 N2) . 1.5H2 O'
_chemical_formula_sum            'C10 H16 Ag N4 O7.5'
_chemical_formula_weight         420.14
_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                 122.958(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            6
_cell_length_a                   28.123(8)
_cell_length_b                   5.2414(15)
_cell_length_c                   24.723(7)
_cell_measurement_temperature    298(2)
_cell_volume                     3057.8(15)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.369
_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        'C10 H16 Ag N4 O7.50'
_cod_database_code               8100371
Crystal structure of ethylenediaminesilver(I) di(3,5-dinitro-benzoato) silver(I) dihydrate, Ag~2~(C~2~H~8~N~2~)(C~7~H~3~N~2~O~6~)~2~ · 2H~2~O
Chen, Sheng-Hui; Zeng, Qing-Fu; Xia, Dong-Sheng; Wang, Da-Qi; Zhu, Hai-Liang; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 305–306; doi:

data_8100372
_publ_section_title
;
Crystal structure of ethylenediaminesilver(I) di(3,5-dinitro-benzoato)
silver(I) dihydrate, Ag~2~(C~2~H~8~N~2~)(C~7~H~3~N~2~O~6~)~2~ &#x00B7; 2H~2~O
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              305
_journal_page_last               306
_journal_volume                  218
_journal_year                    2003
_chemical_formula_moiety         'C16 H14 Ag2 N6 O12, 2H2O'
_chemical_formula_sum            'C16 H18 Ag2 N6 O14'
_chemical_formula_weight         734.10
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                84.320(6)
_cell_angle_beta                 76.810(5)
_cell_angle_gamma                79.612(6)
_cell_formula_units_Z            2
_cell_length_a                   6.978(2)
_cell_length_b                   12.919(5)
_cell_length_c                   15.029(5)
_cell_measurement_temperature    298(2)
_cell_volume                     1295.2(8)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.882
_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               8100372
Crystal structure of ethylenediaminesilver(I) perchlorate, C~2~H~8~N~2~Ag (ClO~4~)
Zhu, Hai-Liang; Zhang, Xian-Ming; Yu, Qi; Wang, Da-Qi; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 307–308; doi:

data_8100373
_publ_section_title
;
Crystal structure of ethylenediaminesilver(I) perchlorate, C~2~H~8~N~2~Ag
(ClO~4~)
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              307
_journal_page_last               308
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'C2 H8 Ag Cl N2 O4'
_chemical_formula_sum            'C2 H8 Ag Cl N2 O4'
_chemical_formula_weight         267.42
_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                 111.240(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.676(3)
_cell_length_b                   9.869(3)
_cell_length_c                   8.822(3)
_cell_measurement_temperature    293(2)
_cell_volume                     704.0(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    2.523
_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        'C2 H8 Ag1 Cl1 N2 O4'
_cod_database_code               8100373
Crystal structure of 1,2-diaminopropanesilver(I) 3,5-dinitrobenzoate — ammonia (1:1), Ag(C~3~H~10~N~2~)(C~7~H~3~N~2~O~6~) · NH~3~
Zhu, Hai-Liang; Zhang, Xian-Ming; Wang, Xian-Jiang; Wang, Da-Qi; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 309–310; doi:

data_8100374
_publ_section_title
;
Crystal structure of 1,2-diaminopropanesilver(I) 3,5-dinitrobenzoate 
--- ammonia (1:1), Ag(C~3~H~10~N~2~)(C~7~H~3~N~2~O~6~) &#x00B7; NH~3~
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              309
_journal_page_last               310
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'C10 H16 Ag N5 O6'
_chemical_formula_sum            'C10 H16 Ag N5 O6'
_chemical_formula_weight         410.15
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                84.244(12)
_cell_angle_beta                 79.049(15)
_cell_angle_gamma                72.731(8)
_cell_formula_units_Z            2
_cell_length_a                   5.640(5)
_cell_length_b                   9.499(8)
_cell_length_c                   14.844(16)
_cell_measurement_temperature    298(2)
_cell_volume                     744.8(12)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.829
_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               8100374
Crystal structure of dinitrato-dimethanol-bis[N-(2-aminopropyl)- salicylaldiminato]dicadmium(II), Cd~2~(C~10~H~13~N~2~O)~2~(NO~3~)~2~(CH~3~OH)~2~
Xia, Dong-Sheng; Wang, Ya-Feng; Liu, Wei-Jiang; Zeng, Qing-Fu; Wang, Da-Qi; Zhu, Hai-Liang; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 311–312; doi:

data_8100375
_publ_section_title
;
Crystal structure of dinitrato-dimethanol-bis[N-(2-aminopropyl)-
salicylaldiminato]dicadmium(II), 
Cd~2~(C~10~H~13~N~2~O)~2~(NO~3~)~2~(CH~3~OH)~2~
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              311
_journal_page_last               312
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'Cd2 (C10 H13 N2 O)2 (NO3)2 (CH3 OH)2'
_chemical_formula_sum            'C22 H34 Cd2 N6 O10'
_chemical_formula_weight         767.35
_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                85.445(4)
_cell_angle_beta                 71.174(4)
_cell_angle_gamma                88.390(4)
_cell_formula_units_Z            1
_cell_length_a                   7.832(2)
_cell_length_b                   9.275(3)
_cell_length_c                   10.497(3)
_cell_measurement_temperature    293(2)
_cell_volume                     719.4(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.771
_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               8100375
Crystal structure of diaqua-di(2-methoxyacetato)cobalt(II), C~6~H~14~CoO~8~
Zhu, Hai-Liang; Liu, Xing; Zhu, Xiu-Liang; Wang, Da-Qi; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 313–314; doi:

data_8100376
_publ_section_title
;
Crystal structure of diaqua-di(2-methoxyacetato)cobalt(II), C~6~H~14~CoO~8~
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              313
_journal_page_last               314
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'C6 H14 Co1 O8'
_chemical_formula_sum            'C6 H14 Co O8'
_chemical_formula_weight         273.10
_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                 97.15(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   6.985(1)
_cell_length_b                   10.102(2)
_cell_length_c                   7.132(1)
_cell_measurement_temperature    292(2)
_cell_volume                     499.34(14)
_diffrn_ambient_temperature      292(2)
_exptl_crystal_density_diffrn    1.816
_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        'C6 H14 Co1 O8'
_cod_database_code               8100376
Crystal structure of 1,2-bis(salicylideneiminato)propane-chromium (III) nitrate, C~17~H~20~CrN~3~O~7~
Zhu, Hai-Liang; Liu, Xing; Zhu, Xiu-Liang; Wang, Da-Qi; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 335–336; doi:

data_8100377
_publ_section_title
;
Crystal structure of 1,2-bis(salicylideneiminato)propane-chromium
(III) nitrate, C~17~H~20~CrN~3~O~7~
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              335
_journal_page_last               336
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'C17 H20 Cr N3 O7'
_chemical_formula_sum            'C17 H20 Cr N3 O7'
_chemical_formula_weight         430.36
_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                 97.246(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   18.905(7)
_cell_length_b                   13.915(5)
_cell_length_c                   14.822(6)
_cell_measurement_temperature    298(2)
_cell_volume                     3868(3)
_diffrn_ambient_temperature      298(2)
_exptl_crystal_density_diffrn    1.478
_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        'C17 H20 Cr1 N3 O7'
_cod_database_code               8100377
Crystal structure of diaqua-di(2-methoxyacetato)copper(II), C~6~H~14~CuO~8~
Zhu, Hai-Liang; Zhu, Xiu-Liang; Liu, Xing; Wang, Da-Qi; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 315–316; doi:

data_8100378
_publ_section_title
;
Crystal structure of diaqua-di(2-methoxyacetato)copper(II), C~6~H~14~CuO~8~
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              315
_journal_page_last               316
_journal_volume                  218
_journal_year                    2003
_chemical_formula_structural     'C6 H14 Cu O8'
_chemical_formula_sum            'C6 H14 Cu O8'
_chemical_formula_weight         277.71
_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                90.00
_cell_angle_beta                 96.57(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   6.955(1)
_cell_length_b                   10.123(2)
_cell_length_c                   7.226(1)
_cell_measurement_temperature    292(2)
_cell_volume                     505.41(14)
_diffrn_ambient_temperature      292(2)
_exptl_crystal_density_diffrn    1.825
_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        'C6 H14 Cu1 O8'
_cod_database_code               8100378
Crystal structure of 4-di(2-pyridinoamino)methylbenzaldehyde, C~18~H~16~N~4~O
Zhu, Hai-Liang; Liu, Qiong-Xin; Liu, Xiu-Ying; Yang, Feng; Wang, Zen-Dong; Zeitschrift für Kristallographie - New Crystal Structures 218 (2003) 317–318; doi:

data_8100379
_publ_section_title
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Crystal structure of 4-di(2-pyridinoamino)methylbenzaldehyde, C~18~H~16~N~4~O
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              317
_journal_page_last               318
_journal_volume                  218
_journal_year                    2003
_chemical_formula_moiety         'C18 H16 N4 O'
_chemical_formula_sum            'C18 H16 N4 O'
_chemical_formula_weight         304.35
_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                 105.4950(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.7420(6)
_cell_length_b                   12.7228(7)
_cell_length_c                   11.8769(7)
_cell_measurement_temperature    293(2)
_cell_volume                     1564.20(15)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.292
_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               8100379