LMucko/crystallography-open-database huggingface dataset:
Crystal structure of 1,2-bis(dicyclohexylphosphino)-ethane rhodium (I)-norborna-2,5-diene tetrafluoroborate, C~33~H~56~BF~4~P~2~Rh and of 1,2-bis(dicyclohexylphosphino)-ethane rhodium(I)-(Z,Z)-cycloocta- 1,5-diene tetrafluoroborate, C~34~H~60~BF~4~P~2~Rh · 1/2CH~3~OH
Kempe, Rhett; Spannenberg, Anke; Drexler, Hans-Joachim; Heller, Detlef; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 165–168; doi:

data_8100882
_publ_section_title
;
Crystal structure of 1,2-bis(dicyclohexylphosphino)-ethane rhodium
(I)-norborna-2,5-diene tetrafluoroborate, C~33~H~56~BF~4~P~2~Rh and 
of 1,2-bis(dicyclohexylphosphino)-ethane rhodium(I)-(Z,Z)-cycloocta-
1,5-diene tetrafluoroborate, C~34~H~60~BF~4~P~2~Rh &#x00B7; 1/2CH~3~OH
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              165
_journal_page_last               168
_journal_volume                  216
_journal_year                    2001
_chemical_formula_sum            'C34.5 H62 B F4 O0.5 P2 Rh'
_chemical_formula_weight         736.50
_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                 114.51(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   20.009(4)
_cell_length_b                   10.335(2)
_cell_length_c                   19.638(4)
_cell_measurement_temperature    200(2)
_cell_volume                     3695.1(13)
_diffrn_ambient_temperature      200(2)
_exptl_crystal_density_diffrn    1.324
_refine_ls_R_factor_obs          0.0463
_refine_ls_wR_factor_obs         0.1129
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2017-07-12

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_original_formula_sum        'C34.50 H62 B F4 O0.50 P2 Rh'
_cod_database_code               8100882
Crystal structure of tris(diformylamino)methane, C~7~H~7~N~3~O~6~
Frey, Wolfgang; Kantlehner, Willi; Ziegler, Georg; Scherr, Oliver; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 97–98; doi:

data_8100883
_publ_section_title
;
Crystal structure of tris(diformylamino)methane, C~7~H~7~N~3~O~6~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              97
_journal_page_last               98
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'C7 H7 N3 O6'
_chemical_formula_sum            'C7 H7 N3 O6'
_chemical_formula_weight         229.16
_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                   12.159(2)
_cell_length_b                   10.661(2)
_cell_length_c                   14.813(2)
_cell_measurement_temperature    293(2)
_cell_volume                     1920.1(6)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.585
_refine_ls_R_factor_obs          0.0427
_refine_ls_wR_factor_obs         0.1068
_cod_database_code               8100883
Crystal structure of chloro{2,2'-[(R,R)-cyclohexane-1,2-diylbis (nitrilomethylidyne)]-bis[6-tert-butyl-4-(triphenylphosphoniomethyl) phenolato]-O,N,N',O'}-iron(III) bis(hexafluorophosphate) tris(ethanol) solvate, [Fe(C~66~H~68~N~2~O~2~P~2~)Cl](PF~6~)~2~ · 3C~2~H~6~O
Pajunen, A.; Mutikainen, I.; Haikarainen, A.; Sipilä, J.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 147–150; doi:

data_8100884
_publ_section_title
;
Crystal structure of chloro{2,2'-[(R,R)-cyclohexane-1,2-diylbis
(nitrilomethylidyne)]-bis[6-tert-butyl-4-(triphenylphosphoniomethyl)
phenolato]-O,N,N',O'}-iron(III) bis(hexafluorophosphate) tris(ethanol) 
solvate, [Fe(C~66~H~68~N~2~O~2~P~2~)Cl](PF~6~)~2~ &#x00B7; 3C~2~H~6~O
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              147
_journal_page_last               150
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'C72 H86 Cl F12 Fe N2 O5 P4'
_chemical_formula_sum            'C72 H86 Cl F12 Fe N2 O5 P4'
_chemical_formula_weight         1502.61
_space_group_IT_number           1
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                107.52(4)
_cell_angle_beta                 101.97(5)
_cell_angle_gamma                80.80(5)
_cell_formula_units_Z            2
_cell_length_a                   14.094(9)
_cell_length_b                   21.592(12)
_cell_length_c                   13.660(7)
_cell_measurement_temperature    193(2)
_cell_volume                     3857(4)
_diffrn_ambient_temperature      193(2)
_exptl_crystal_density_diffrn    1.294
_cod_database_code               8100884
Crystal structure of N,N'-ethylenbis(4-propanoyl-2,4-dihydro-5-methyl 2-phenyl-3H-pyrazol-3-oneimine), C~28~H~32~N~6~O~2~
Uzoukwu, Bieluonwu A.; Gloe, Karsten; Duddeck, Helmut; Rademacher, Otto; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 151–152; doi:

data_8100885
_publ_section_title
;
Crystal structure of N,N'-ethylenbis(4-propanoyl-2,4-dihydro-5-methyl 
2-phenyl-3H-pyrazol-3-oneimine), C~28~H~32~N~6~O~2~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              151
_journal_page_last               152
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'C28 H32 N6 O2'
_chemical_formula_sum            'C28 H32 N6 O2'
_chemical_formula_weight         484.60
_chemical_melting_point          487
_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                88.99(2)
_cell_angle_beta                 86.60(2)
_cell_angle_gamma                75.91(2)
_cell_formula_units_Z            1
_cell_length_a                   7.911(3)
_cell_length_b                   8.250(3)
_cell_length_c                   9.978(3)
_cell_measurement_temperature    293(2)
_cell_volume                     630.5(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.276
_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               8100885
Crystal structure of aquo-(N,N,N',N'-1,1,4,4-tetramethylethenediamine)- tricarbonyl-manganese(I) tetrafluoroborate, [(H~2~O)(CO)~3~(C~6~H~16~N~2~)Mn](BF~4~)
Horn, E.; Onai, S.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 73–76; doi:10.1524/ncrs.2001.216.14.73

data_8100886
_publ_section_title
;
 Crystal structure of aquo-(N,N,N',N'-1,1,4,4-tetramethylethenediamine)-
 tricarbonyl-manganese(I) tetrafluoroborate,
 [(H~2~O)(CO)~3~(C~6~H~16~N~2~)Mn](BF~4~)
;
_journal_coden_ASTM              ZKNSFT
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              73
_journal_page_last               76
_journal_paper_doi               10.1524/ncrs.2001.216.14.73
_journal_volume                  216
_journal_year                    2001
_chemical_formula_moiety         'C10 H18 Br N2 O3 Re'
_chemical_formula_structural     '[Re(CO)3(C7 H18 N2)Br]'
_chemical_formula_sum            'C10 H18 Br N2 O3 Re'
_chemical_formula_weight         480.37
_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                   14.496(2)
_cell_length_b                   13.338(2)
_cell_length_c                   14.722(2)
_cell_measurement_temperature    296.2
_cell_volume                     2846.3(5)
_diffrn_ambient_temperature      296.2
_exptl_crystal_density_diffrn    2.242
_refine_ls_R_factor_obs          0.0419
_refine_ls_wR_factor_obs         0.0504
_cod_database_code               8100886
Crystal structure of (S)-2,3-O,N-bis(diphenylphosphino)-1-(naphthoxy)- 2-hydroxy-3-cyclohexylamino-propane rhodium(I)-(Z,Z)-cycloocta-1,5- diene tetrafluoroborate, C~51~H~55~BF~4~NO~2~P~2~Rh
Drexler, H.-J.; Spannenberg, A.; Heller, D.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 169–171; doi:

data_8100887
_publ_section_title
;
Crystal structure of (S)-2,3-O,N-bis(diphenylphosphino)-1-(naphthoxy)-
2-hydroxy-3-cyclohexylamino-propane rhodium(I)-(Z,Z)-cycloocta-1,5-
diene tetrafluoroborate, C~51~H~55~BF~4~NO~2~P~2~Rh
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              169
_journal_page_last               171
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'C51 H55 B F4 N O2 P2 Rh'
_chemical_formula_sum            'C51 H55 B F4 N O2 P2 Rh'
_chemical_formula_weight         965.62
_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                 118.03(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   13.010(3)
_cell_length_b                   15.264(3)
_cell_length_c                   13.136(3)
_cell_measurement_temperature    200(2)
_cell_volume                     2302.6(8)
_diffrn_ambient_temperature      200(2)
_exptl_crystal_density_diffrn    1.393
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               8100887
Crystal structure of mercury(II) trihydrogenhexaoxoiodate(VII), HgH~3~IO~6~
Mormann, Thomas J.; Jeitschko, Wolfgang; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 1–2; doi:10.1524/ncrs.2001.216.14.1

data_8100888
_publ_section_title
;
Crystal structure of mercury(II) trihydrogenhexaoxoiodate(VII), HgH~3~IO~6~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              1
_journal_page_last               2
_journal_paper_doi               10.1524/ncrs.2001.216.14.1
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Hg H3 I O6'
_chemical_formula_sum            'H3 Hg I O6'
_chemical_formula_weight         426.51
_space_group_IT_number           1
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                65.307(6)
_cell_angle_beta                 76.451(6)
_cell_angle_gamma                63.859(7)
_cell_formula_units_Z            1
_cell_length_a                   4.8085(7)
_cell_length_b                   5.3115(7)
_cell_length_c                   5.6116(8)
_cell_measurement_temperature    293(2)
_cell_volume                     116.68(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    6.070
_cod_database_code               8100888
Redetermination of the crystal structure of heptalithium tetranitridovanadate(V), Li~7~[VN~4~]
Niewa, Rainer; Kniep, Rüdiger; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 5–6; doi:

data_8100889
_publ_section_title
;
Redetermination of the crystal structure of heptalithium 
tetranitridovanadate(V), Li~7~[VN~4~]
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              5
_journal_page_last               6
_journal_volume                  216
_journal_year                    2001
_chemical_formula_moiety         Li7[VN4]
_chemical_formula_structural     'Li7 [V N4]'
_chemical_formula_sum            'Li7 N4 V'
_chemical_formula_weight         155.56
_space_group_IT_number           205
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P a -3'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.599(2)
_cell_length_b                   9.599(2)
_cell_length_c                   9.599(2)
_cell_measurement_temperature    293(2)
_cell_volume                     884.5(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    2.336
_cod_database_code               8100889
Crystal structure of lithium copper(II) monoaqua catena-[monoboro- diphosphate] dihydrate, LiCu(H~2~O)[BP~2~O~8~] · 2H~2~O
Boy, I.; Kniep, R.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 7–8; doi:

data_8100890
_publ_section_title
;
Crystal structure of lithium copper(II) monoaqua catena-[monoboro-
diphosphate] dihydrate, LiCu(H~2~O)[BP~2~O~8~] &#x00B7; 2H~2~O
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              7
_journal_page_last               8
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Li Cu (H2 O)[B P2 O8] * 2H2 O'
_chemical_formula_sum            'B Cu Li O11 P2'
_chemical_formula_weight         319.23
_space_group_IT_number           169
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  'P 61'
_symmetry_space_group_name_H-M   'P 61'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            6
_cell_length_a                   9.520(4)
_cell_length_b                   9.520(4)
_cell_length_c                   15.438(6)
_cell_measurement_temperature    293(2)
_cell_volume                     1211.7(9)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    2.625
_cod_database_code               8100890
Crystal structure of lithium zinc diaqua catena-[monoboro-diphosphate]- monohydrate, LiZn(H~2~O)~2~[BP~2~O~8~] · H~2~O
Boy, I.; Kniep, R.; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 9–10; doi:

data_8100891
_publ_section_title
;
Crystal structure of lithium zinc diaqua catena-[monoboro-diphosphate]-
monohydrate, LiZn(H~2~O)~2~[BP~2~O~8~] &#x00B7; H~2~O
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              9
_journal_page_last               10
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Li Zn(H2 O)2 [B P2 O8] * H2 O'
_chemical_formula_sum            'B Li O11 P2 Zn'
_chemical_formula_weight         321.06
_space_group_IT_number           169
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  'P 61'
_symmetry_space_group_name_H-M   'P 61'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            6
_cell_length_a                   9.469(2)
_cell_length_b                   9.469(2)
_cell_length_c                   15.667(2)
_cell_measurement_temperature    293(2)
_cell_volume                     1216.5(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    2.630
_cod_database_code               8100891
Crystal structure of caesium μ-oxonickel(II)bissilicate, Cs~6~ [NiSi~2~O~8~]
Hansing, J.; Amann, Peter; Möller, Angela; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 17–17; doi:

data_8100892
_publ_section_title
;
Crystal structure of caesium \m-oxonickel(II)bissilicate, Cs~6~
[NiSi~2~O~8~]
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              17
_journal_page_last               17
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Cs6 Ni O8 Si2'
_chemical_formula_sum            'Cs6 Ni O8 Si2'
_chemical_formula_weight         1040.35
_chemical_name_common            Caesium-nickel(II)silicate
_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                87.36(3)
_cell_angle_beta                 88.79(3)
_cell_angle_gamma                70.08(3)
_cell_formula_units_Z            1
_cell_length_a                   6.8917(16)
_cell_length_b                   7.0432(16)
_cell_length_c                   8.0687(18)
_cell_measurement_temperature    293(2)
_cell_volume                     367.82(14)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    4.697
_cod_database_code               8100892
Refinement of the crystal structure of gallium trifluoride, GaF~3~
Roos, Meike; Meyer, Gerd; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 18–18; doi:

data_8100893
_publ_section_title
;
Refinement of the crystal structure of gallium trifluoride, GaF~3~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              18
_journal_page_last               18
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Ga F3'
_chemical_formula_sum            'F3 Ga'
_chemical_formula_weight         253.44
_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                   5.012(4)
_cell_length_b                   5.012(4)
_cell_length_c                   12.99(1)
_cell_measurement_temperature    293(2)
_cell_volume                     282.7
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    4.466
_cod_original_sg_symbol_H-M      'R -3 c'
_cod_database_code               8100893
Crystal structure of trisodium holmium(III) hexachloride, Na~3~HoCl~6~
Böcker, Marlies; Gerlitzki, Niels; Meyer, Gerd; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 19–19; doi:

data_8100894
_publ_section_title
;
Crystal structure of trisodium holmium(III) hexachloride, Na~3~HoCl~6~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              19
_journal_page_last               19
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Na3 Ho Cl6'
_chemical_formula_sum            'Cl6 Ho Na3'
_chemical_formula_weight         446.60
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.789(16)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   6.8683(9)
_cell_length_b                   7.2737(11)
_cell_length_c                   10.1668(14)
_cell_measurement_temperature    293(2)
_cell_volume                     507.86(12)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.460
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               8100894
Refinement of the crystal structure of diammonium hexafluorostannate (IV), (NH~4~)~2~SnF~6~
Meyer, Gerd; Böhmer, Norbert; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 20–20; doi:

data_8100895
_publ_section_title
;
Refinement of the crystal structure of diammonium hexafluorostannate
(IV), (NH~4~)~2~SnF~6~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              20
_journal_page_last               20
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     '(NH4)2 Sn F6'
_chemical_formula_sum            'F6 H8 N2 Sn'
_chemical_formula_weight         268.77
_space_group_IT_number           164
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            1
_cell_length_a                   6.0810(12)
_cell_length_b                   6.0810(12)
_cell_length_c                   4.8653(10)
_cell_measurement_temperature    293(2)
_cell_volume                     155.81(5)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    2.864
_cod_original_formula_sum        'H8 F6 N2 Sn'
_cod_database_code               8100895
Crystal structure of ytterbium copper stannide, Yb~4~Cu~2~Sn~5~
Fornasini, Maria L.; Zanicchi, Gilda; Mazzone, Donata; Riani, Paola; Zeitschrift für Kristallographie - New Crystal Structures 216 (2001) 21–22; doi:

data_8100896
_publ_section_title
;
Crystal structure of ytterbium copper stannide, Yb~4~Cu~2~Sn~5~
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              21
_journal_page_last               22
_journal_volume                  216
_journal_year                    2001
_chemical_formula_structural     'Yb4 Cu2 Sn5'
_chemical_formula_sum            'Cu2 Sn5 Yb4'
_chemical_formula_weight         1412.69
_space_group_IT_number           59
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ab 2a'
_symmetry_space_group_name_H-M   'P m m n :2'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   4.413(1)
_cell_length_b                   13.887(2)
_cell_length_c                   8.830(1)
_cell_measurement_temperature    293(2)
_cell_volume                     541.1(2)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    8.670
_refine_ls_R_factor_obs          0.0322
_refine_ls_wR_factor_obs         0.0625
_cod_original_sg_symbol_H-M      'P m m n'
_cod_database_code               8100896