LMucko/crystallography-open-database huggingface dataset:
Crystal structure of 4-phenylimidazole, C~9~H~8~N~2~
Staples, Richard J.; Sonderegger, Lori H.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 313–314; doi:

data_8100968
_publ_section_title
;
Crystal structure of 4-phenylimidazole, C~9~H~8~N~2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              313
_journal_page_last               314
_journal_volume                  216
_journal_year                    2001
_chemical_formula_moiety         'C9 H8 N2'
_chemical_formula_sum            'C9 H8 N2'
_chemical_formula_weight         144.17
_chemical_melting_point          129.5(15)
_space_group_IT_number           7
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P -2yc'
_symmetry_space_group_name_H-M   'P 1 c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 100.814(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.4562(6)
_cell_length_b                   12.4669(8)
_cell_length_c                   6.9661(5)
_cell_measurement_temperature    213(2)
_cell_volume                     806.65(9)
_diffrn_ambient_temperature      213(2)
_exptl_crystal_density_diffrn    1.187
_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 '128-131' was changed to '129.5(15)'
- 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_original_sg_symbol_H-M      'P c'
_cod_database_code               8100968
Crystal structure of 1,4-bis(ethylamino)anthracene-9,10-dione, C~18~H~18~N~2~O~2~
Schneider, G. M.; Tuma, D.; Winter, M.; Wagner, B.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 299–300; doi:

data_8100969
_publ_section_title
;Crystal structure of 1,4-bis(ethylamino)anthracene-9,10-dione,
 C~18~H~18~N~2~O~2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              299
_journal_page_last               300
_journal_volume                  216
_journal_year                    2001
_chemical_formula_sum            'C18 H18 N2 O2'
_chemical_formula_weight         294.34
_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                 106.495(13)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   14.1614(16)
_cell_length_b                   15.5672(11)
_cell_length_c                   6.9883(8)
_cell_measurement_temperature    293(2)
_cell_volume                     1477.2(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.324
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               8100969
Crystal structure of diaqua-di-μ~2~-aqua-bis(pyridazine)-bis (μ~2~-(1,2)-squarato)-dicopper(II) dihydrate, [Cu(C~5~H~4~N~2~) (C~4~O~4~)(H~2~O)~2~] · H~2~O
Krupicka, Erik; Lentz, Axel; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 289–290; doi:

data_8100970
_publ_section_title
;
Crystal structure of diaqua-di-\m~2~-aqua-bis(pyridazine)-bis
(\m~2~-(1,2)-squarato)-dicopper(II) dihydrate, [Cu(C~5~H~4~N~2~)
(C~4~O~4~)(H~2~O)~2~] &#x00B7; H~2~O
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              289
_journal_page_last               290
_journal_volume                  216
_journal_year                    2001
_chemical_formula_moiety         '(Cu 2+), (C5 H4 N2), (C4 O4 2-), 3(H2 O)'
_chemical_formula_structural     '[Cu(C5 H4 N2)(C4 O4)(H2 O)2] . H2 O'
_chemical_formula_sum            'C8 H10 Cu N2 O7'
_chemical_formula_weight         309.72
_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                 111.203(12)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.1337(9)
_cell_length_b                   13.721(2)
_cell_length_c                   10.7563(12)
_cell_measurement_temperature    293(2)
_cell_volume                     1119.2(2)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.838
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               8100970
Crystal structure of 3-hydroxy-8-methyltricyclo-[5.3.1.0^3,8^]undec- 5-en-2-one, C~12~H~16~O~2~
Oesterreich, Kai; Spitzner, Dietrich; Oeckler, Oliver; Simon, Arndt; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 293–294; doi:

data_8100971
_publ_section_title
;
Crystal structure of 3-hydroxy-8-methyltricyclo-[5.3.1.0^3,8^]undec-
5-en-2-one, C~12~H~16~O~2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              293
_journal_page_last               294
_journal_volume                  216
_journal_year                    2001
_chemical_formula_sum            'C12 H16 O2'
_chemical_formula_weight         192.25
_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                 149.49(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.476(3)
_cell_length_b                   11.134(2)
_cell_length_c                   14.100(3)
_cell_measurement_temperature    93(2)
_cell_volume                     994.4(3)
_diffrn_ambient_temperature      93(2)
_exptl_crystal_density_diffrn    1.284
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               8100971
Refinement of the crystal structure of trans-chloro-phenyl-bis (triphenylphosphine)platinum(II) at 173 K, C~42~H~35~ClP~2~Pt
Crisp, M. G.; Rendina, L. M.; Tiekink, E.R.T.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 249–250; doi:

data_8100972
_publ_section_title
;
Refinement of the crystal structure of trans-chloro-phenyl-bis
(triphenylphosphine)platinum(II) at 173 K, C~42~H~35~ClP~2~Pt
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              249
_journal_page_last               250
_journal_volume                  216
_journal_year                    2001
_chemical_formula_moiety         'C42 H35 Cl P2 Pt '
_chemical_formula_sum            'C42 H35 Cl P2 Pt'
_chemical_formula_weight         832.23
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   23.517(3)
_cell_length_b                   25.616(3)
_cell_length_c                   11.769(2)
_cell_measurement_temperature    173
_cell_volume                     7090(2)
_diffrn_ambient_temperature      173
_exptl_crystal_density_diffrn    1.559
_cod_original_formula_sum        'C42 H35 Cl P2 Pt '
_cod_database_code               8100972
Crystal structure of 4'-hydroxy-5,6-benzoflavone, C~19~H~12~O~3~
Shoja, M.; Krikava, A.; Kabbani, R.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 301–302; doi:

data_8100973
_publ_section_title
;
Crystal structure of 4'-hydroxy-5,6-benzoflavone, C~19~H~12~O~3~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              301
_journal_page_last               302
_journal_volume                  216
_journal_year                    2001
_chemical_formula_sum            'C19 H12 O3'
_chemical_formula_weight         288.29
_chemical_melting_point          577.0(10)
_chemical_name_common            4'-hydroxy-\b-naphthoflavone
_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                90.00000
_cell_angle_beta                 92.37(3)
_cell_angle_gamma                90.00000
_cell_formula_units_Z            4
_cell_length_a                   8.157(4)
_cell_length_b                   15.091(2)
_cell_length_c                   11.035(2)
_cell_measurement_temperature    293
_cell_volume                     1357.2(7)
_diffrn_ambient_temperature      293
_exptl_crystal_density_diffrn    1.411
_refine_ls_R_factor_obs          .06
_refine_ls_wR_factor_obs         .064
_cod_depositor_comments
;
The following automatic conversions were performed:

'_chemical_melting_point' value '576-578' was changed to '577.0(10)'
- 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_original_sg_symbol_Hall     -p_2ybc
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               8100973
Crystal structure of 2',4'-dimethoxy-3-hydroxyflavone, C~17~H~14~O~5~
Shoja, M.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 303–304; doi:

data_8100974
_publ_section_title
;
Crystal structure of 2',4'-dimethoxy-3-hydroxyflavone, C~17~H~14~O~5~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              303
_journal_page_last               304
_journal_volume                  216
_journal_year                    2001
_chemical_formula_sum            'C17 H14 O5'
_chemical_formula_weight         298.30
_chemical_melting_point          476.0(10)
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                107.695(10)
_cell_angle_beta                 100.064(10)
_cell_angle_gamma                108.766(10)
_cell_formula_units_Z            2
_cell_length_a                   7.377(3)
_cell_length_b                   9.619(3)
_cell_length_c                   11.901(3)
_cell_measurement_temperature    293
_cell_volume                     726.2(4)
_diffrn_ambient_temperature      293
_exptl_crystal_density_diffrn    1.599
_refine_ls_R_factor_obs          .037
_refine_ls_wR_factor_obs         .039
_cod_depositor_comments
;
The following automatic conversions were performed:

'_chemical_melting_point' value '475-477 K' was changed to
'476.0(10)' - 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_original_sg_symbol_H-M      P-1
_cod_database_code               8100974
Crystal structure of (pM*,pM*)-(±)-bi-(dimethyl-3,6-decanooxepine- 4,5-dicarboxylate), [C~6~HO(CH~2~)~10~(COOCH~3~)~2~]~2~
Peters, Eva-Maria; Peters, Karl; Meints, Christine; Tochtermann, Werner; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 305–306; doi:

data_8100975
_publ_section_title
;
Crystal structure of (pM*,pM*)-(+-)-bi-(dimethyl-3,6-decanooxepine-
4,5-dicarboxylate), [C~6~HO(CH~2~)~10~(COOCH~3~)~2~]~2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              305
_journal_page_last               306
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     '[[C6 H O(C H2)10(C O O C H3)2]2'
_chemical_formula_sum            'C40 H54 O10'
_chemical_formula_weight         694.83
_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                 104.430(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   18.520(3)
_cell_length_b                   9.611(2)
_cell_length_c                   21.901(4)
_cell_measurement_temperature    293(2)
_cell_volume                     3775.3(12)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.222
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               8100975
Crystal structure of methyl(1R*,12R*,13S*,15R*)-9-aza-11-diazo-14, 16- dioxa-10-oxo-tetracyclo[10.4.0.0^1,15^.0^8,13^]hexadec-7-ene-12- carboxylate, (C~3~HNHCOCN~2~)(C~2~HO~2~)(C~6~H~11~)COOCH~3~
Peters, Eva-Maria; Peters, Karl; Ott, Frank; Tochtermann, Werner; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 307–308; doi:

data_8100976
_publ_section_title
;
Crystal structure of methyl(1R*,12R*,13S*,15R*)-9-aza-11-diazo-14,
16- dioxa-10-oxo-tetracyclo[10.4.0.0^1,15^.0^8,13^]hexadec-7-ene-12-
carboxylate, (C~3~HNHCOCN~2~)(C~2~HO~2~)(C~6~H~11~)COOCH~3~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              307
_journal_page_last               308
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     '(C3 HNHCOC N2 )(C2 H O2 )(C6 H11)COOC H3'
_chemical_formula_sum            'C15 H17 N3 O5'
_chemical_formula_weight         319.32
_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                 124.497(8)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   22.658(3)
_cell_length_b                   10.764(2)
_cell_length_c                   15.261(2)
_cell_measurement_temperature    293(2)
_cell_volume                     3067.8(8)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.383
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               8100976
Crystal structure of the chiral clathrate, Na~2~Ba~4~Ge~25~
Carrillo-Cabrera, Wilder; Curda, Jan; Peters, Karl; Paschen, Silke; Grin, Yuri; von Schnering, Hans Georg; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 183–184; doi:

data_8100977
_publ_section_title
;
Crystal structure of the chiral clathrate, Na~2~Ba~4~Ge~25~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              183
_journal_page_last               184
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Ba4 Na2 Ge25'
_chemical_formula_sum            'Ba4 Ge25 Na2'
_chemical_formula_weight         2410.09
_space_group_IT_number           213
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'P 4bd 2ab 3'
_symmetry_space_group_name_H-M   'P 41 3 2'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   14.4703(2)
_cell_length_b                   14.4703(2)
_cell_length_c                   14.4703(2)
_cell_measurement_temperature    293(2)
_cell_volume                     3029.93(7)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    5.283
_cod_database_code               8100977
Crystal structure of calcium lithium plumbide (1/1/1), CaLiPb, and ytterbium lithium plumbide (1/1/1), YbLiPb
Fornasini, Maria L.; Merlo, Franco; Pani, Marcella; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 173–174; doi:

data_8100978
_publ_section_title
;
Crystal structure of calcium lithium plumbide (1/1/1), CaLiPb, and 
ytterbium lithium plumbide (1/1/1), YbLiPb
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              173
_journal_page_last               174
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Ca Li Pb'
_chemical_formula_sum            'Ca Li Pb'
_chemical_formula_weight         254.21
_space_group_IT_number           187
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  'P -6 2'
_symmetry_space_group_name_H-M   'P -6 m 2'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   4.9330(10)
_cell_length_b                   4.9330(10)
_cell_length_c                   10.9900(10)
_cell_measurement_temperature    293(2)
_cell_volume                     231.61(7)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    5.468
_refine_ls_R_factor_obs          0.0484
_refine_ls_wR_factor_obs         0.1239
_cod_database_code               8100978
Crystal structure of calcium lithium plumbide (1/1/1), CaLiPb, and ytterbium lithium plumbide (1/1/1), YbLiPb
Fornasini, Maria L.; Merlo, Franco; Pani, Marcella; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 173–174; doi:

data_8100979
_publ_section_title
;
Crystal structure of calcium lithium plumbide (1/1/1), CaLiPb, and 
ytterbium lithium plumbide (1/1/1), YbLiPb
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              173
_journal_page_last               174
_journal_volume                  216
_journal_year                    2001
_chemical_formula_sum            'Li Pb Yb'
_chemical_formula_weight         387.17
_space_group_IT_number           187
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  'P -6 2'
_symmetry_space_group_name_H-M   'P -6 m 2'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   4.9180(10)
_cell_length_b                   4.9180(10)
_cell_length_c                   10.921(3)
_cell_measurement_temperature    293(2)
_cell_volume                     228.75(9)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    8.431
_refine_ls_R_factor_obs          0.0538
_refine_ls_wR_factor_obs         0.1029
_cod_database_code               8100979
Crystal structure of tetraholmium nickel tetradecaboride, Ho~4~NiB~14~
Geupel, Sandra; Zahn, Gernot; Paufler, Peter; Graw, Gerald; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 175–176; doi:

data_8100980
_publ_section_title
;
Crystal structure of tetraholmium nickel tetradecaboride, Ho~4~NiB~14~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              175
_journal_page_last               176
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Ho4 Ni1 B14'
_chemical_formula_sum            'B14 Ho4 Ni'
_chemical_formula_weight         869.77
_space_group_IT_number           128
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      128
_symmetry_space_group_name_Hall  '-P 4 2n'
_symmetry_space_group_name_H-M   'P 4/m n c'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   7.2097(8)
_cell_length_b                   7.2097(8)
_cell_length_c                   7.4587(9)
_cell_measurement_temperature    300(2)
_cell_volume                     387.70(8)
_diffrn_ambient_temperature      300(2)
_exptl_crystal_density_diffrn    7.451
_cod_original_formula_sum        'B14 Ho4 Ni1'
_cod_database_code               8100980
Crystal structure of tris-tetraamminlithium tetraselenoarsenate(V), [Li(NH~3~)~4~]~3~[AsSe~4~]
Korber, Nikolaus; Grothe, Michael; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 177–178; doi:

data_8100981
_publ_section_title
;
Crystal structure of tris-tetraamminlithium tetraselenoarsenate(V), 
[Li(NH~3~)~4~]~3~[AsSe~4~]
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              177
_journal_page_last               178
_journal_volume                  216
_journal_year                    2001
_chemical_formula_sum            'As H36 Li3 N12 Se4'
_chemical_formula_weight         615.99
_space_group_IT_number           217
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'I -4 2 3'
_symmetry_space_group_name_H-M   'I -4 3 m'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   10.5038(8)
_cell_length_b                   10.5038(8)
_cell_length_c                   10.5038(8)
_cell_measurement_temperature    123(2)
_cell_volume                     1158.88(15)
_diffrn_ambient_temperature      123(2)
_exptl_crystal_density_diffrn    1.765
_cod_original_formula_sum        'H36 As Li3 N12 Se4'
_cod_database_code               8100981
Refinement of the crystal structure of tricesium diyttrium nonachloride, Cs~3~Y~2~Cl~9~
Drozdzynski, J.; Kossowski, K.; Meyer, G.; Müller, I.; Wickleder, M. S.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 179–179; doi:

data_8100982
_publ_section_title
;
Refinement of the crystal structure of tricesium diyttrium nonachloride, 
Cs~3~Y~2~Cl~9~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              179
_journal_page_last               179
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Cs3 Y2 Cl9'
_chemical_formula_sum            'Cl9 Cs3 Y2'
_chemical_formula_weight         895.60
_space_group_IT_number           167
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            6
_cell_length_a                   13.107(2)
_cell_length_b                   13.107(2)
_cell_length_c                   18.333(3)
_cell_measurement_temperature    293(2)
_cell_volume                     2727.4(6)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    3.272
_refine_ls_R_factor_obs          0.0419
_refine_ls_wR_factor_obs         0.0697
_cod_original_sg_symbol_H-M      'R -3 c'
_cod_database_code               8100982