LMucko/crystallography-open-database huggingface dataset:
data_1100167
_chemical_formula_sum            'La Mn O3'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90.00000
_cell_angle_beta                 90.00000
_cell_angle_gamma                90.00000
_cell_formula_units_Z            ?
_cell_length_a                   5.53649(5)
_cell_length_b                   5.74713(5)
_cell_length_c                   7.69259(7)
_cell_volume                     244.770(4)
_diffrn_radiation_probe          neutron
_diffrn_radiation_type           'Constant Wavelength Neutron Diffraction'
_diffrn_radiation_wavelength     1.22720
_diffrn_source                   'nuclear reactor'
_pd_meas_2theta_range_inc        0.050000
_pd_meas_2theta_range_max        125.45000
_pd_meas_2theta_range_min        0.00000
_pd_meas_number_of_points        2510
_pd_proc_2theta_range_inc        0.050000
_pd_proc_2theta_range_max        125.4496
_pd_proc_2theta_range_min        -0.0005
_pd_proc_ls_prof_R_factor        5.0739
_pd_proc_ls_prof_wR_expected     3.9633
_pd_proc_ls_prof_wR_factor       5.9063
_pd_proc_wavelength              1.227200
_refine_ls_number_parameters     28
_refine_ls_number_reflns         438
_refine_ls_number_restraints     3
_refine_ls_R_I_factor            4.9552
_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_original_sg_symbol_H-M      'P B N M'
_cod_database_code               1100167
_pd_proc_ls_prof_cr_factor       9.2733
_pd_proc_ls_prof_cwr_factor      9.0514
_pd_proc_ls_prof_cwr_expected    6.0738
_pd_proc_ls_prof_chi2            2.2208
_pd_proc_ls_prof_echi2           2.2437
Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone
Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus; European Journal of Organic Chemistry 1999 (1999) 2977–2990; doi:10.1002/(sici)1099-0690(199911)1999:11<2977::aid-ejoc2977>3.0.co;2-3

data_1100173
_publ_section_title
;
 Synthesis of Enantiomerically Pure Amino Acids Containing
 2,5-Disubstituted THF Rings in the Molecular Backbone
;
_journal_coden_ASTM              EJOCFK
_journal_issue                   11
_journal_name_full               'European Journal of Organic Chemistry'
_journal_page_first              2977
_journal_page_last               2990
_journal_paper_doi
10.1002/(sici)1099-0690(199911)1999:11<2977::aid-ejoc2977>3.0.co;2-3
_journal_volume                  1999
_journal_year                    1999
_chemical_formula_sum            'C15 H22 N2 O4'
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.3531(11)
_cell_length_b                   10.5002(13)
_cell_length_c                   15.900(2)
_cod_database_code               1100173
Die Kristallstrukturen vontrans-[NiBr~2~(Pyridin)~4~] und [Ni(HNPEt~3~)~4~]I~2~
Gröb, Thorsten; Neumüller, Bernhard; Harms, Klaus; Schmock, Fritjof; Greiner, Andreas; Dehnicke, Kurt; Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 1928–1931; doi:10.1002/1521-3749(200108)627:8<1928::AID-ZAAC1928>3.0.CO;2-V

data_1100174
_publ_section_title
;
 Die Kristallstrukturen vontrans-[NiBr~2~(Pyridin)~4~] und
 [Ni(HNPEt~3~)~4~]I~2~
;
_journal_coden_ASTM              ZAACAB
_journal_issue                   8
_journal_name_full
;
 Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_page_first              1928
_journal_page_last               1931
_journal_paper_doi
10.1002/1521-3749(200108)627:8<1928::AID-ZAAC1928>3.0.CO;2-V
_journal_volume                  627
_journal_year                    2001
_chemical_formula_moiety
;
C24 H64 N4 Ni1 P4 2+,2(I1 1-)
;
_chemical_formula_sum            'C24 H64 I2 N4 Ni P4'
_chemical_name_systematic
;
tetrakis(Triethylphosphoraneimino-N)-nickel(ii) di-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
_cell_angle_beta                 111.040(8)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   19.349(2)
_cell_length_b                   10.7833(7)
_cell_length_c                   19.663(2)
_cell_volume                     3829.087
_diffrn_ambient_temperature      193
_exptl_crystal_colour            colorless.
_exptl_crystal_density_diffrn    1.466
_exptl_crystal_description       prism
_refine_ls_R_factor_gt           4.3
_refine_ls_wR_factor_gt          4.3
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C24 H64 I2 N4 Ni1 P4'
_cod_database_code               1100174
Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von [Hf(NPPh~3~)~4~] · 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~]
Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt; Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 1801–1806; doi:10.1002/1521-3749(200108)627:8<1801::AID-ZAAC1801>3.0.CO;2-9

data_1100175
_publ_section_title
;
 Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von
 [Hf(NPPh~3~)~4~] &#x00B7; 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~]
;
_journal_coden_ASTM              ZAACAB
_journal_issue                   8
_journal_name_full
;
 Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_page_first              1801
_journal_page_last               1806
_journal_paper_doi
10.1002/1521-3749(200108)627:8<1801::AID-ZAAC1801>3.0.CO;2-9
_journal_volume                  627
_journal_year                    2001
_chemical_formula_moiety         'C72 H60 Hf1 N4 P4,3(C4 H8 O1)'
_chemical_formula_sum            'C84 H84 Hf N4 O3 P4'
_chemical_name_systematic
;
tetrakis(Triphenylphosphoraneiminato)-hafnium tetrahydrofuran solvate
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                109.193(4)
_cell_angle_beta                 111.285(4)
_cell_angle_gamma                96.879(4)
_cell_formula_units_Z            4
_cell_length_a                   20.0757(10)
_cell_length_b                   20.642(1)
_cell_length_c                   21.1595(11)
_cell_volume                     7425.962
_diffrn_ambient_temperature      193
_exptl_crystal_colour            colorless.
_exptl_crystal_density_diffrn    1.342
_exptl_crystal_description       prism
_refine_ls_R_factor_gt           5.06
_refine_ls_wR_factor_gt          5.06
_cod_original_formula_sum        'C84 H84 Hf1 N4 O3 P4'
_cod_database_code               1100175
Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von [Hf(NPPh~3~)~4~] · 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~]
Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt; Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 1801–1806; doi:10.1002/1521-3749(200108)627:8<1801::AID-ZAAC1801>3.0.CO;2-9

data_1100176
_publ_section_title
;
 Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von
 [Hf(NPPh~3~)~4~] &#x00B7; 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~]
;
_journal_coden_ASTM              ZAACAB
_journal_issue                   8
_journal_name_full
;
 Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_page_first              1801
_journal_page_last               1806
_journal_paper_doi
10.1002/1521-3749(200108)627:8<1801::AID-ZAAC1801>3.0.CO;2-9
_journal_volume                  627
_journal_year                    2001
_chemical_formula_moiety         'C72 H62 Cl2 Hf1 N4 P4'
_chemical_formula_sum            'C72 H62 Cl2 Hf N4 P4'
_chemical_name_systematic
;
trans-Dichloro-bis(triphenylphosphoraneimine)-bis(triphenylphosphoraneiminato)-hafnium
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                67.273(8)
_cell_angle_beta                 87.445(8)
_cell_angle_gamma                87.082(8)
_cell_formula_units_Z            4
_cell_length_a                   14.4397(10)
_cell_length_b                   19.2812(14)
_cell_length_c                   24.5579(17)
_cell_volume                     6295.928
_diffrn_ambient_temperature      193
_exptl_crystal_colour            colorless.
_exptl_crystal_density_diffrn    1.431
_exptl_crystal_description       irregular
_refine_ls_R_factor_gt           3.12
_refine_ls_wR_factor_gt          3.12
_cod_original_formula_sum        'C72 H62 Cl2 Hf1 N4 P4'
_cod_database_code               1100176
Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents
Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus; Chemistry - A European Journal 6 (2000) 3359–3365; doi:10.1002/1521-3765(20000915)6:18<3359::AID-CHEM3359>3.0.CO;2-U

data_1100177
_publ_section_title
;
 Highly Enantiomerically Enriched \a-Haloalkyl Grignard Reagents
;
_journal_coden_ASTM              CEUJED
_journal_issue                   18
_journal_name_full               'Chemistry - A European Journal'
_journal_page_first              3359
_journal_page_last               3365
_journal_paper_doi
10.1002/1521-3765(20000915)6:18<3359::AID-CHEM3359>3.0.CO;2-U
_journal_volume                  6
_journal_year                    2000
_chemical_formula_moiety         'C15 H15 Cl1 O1 S1'
_chemical_formula_sum            'C15 H15 Cl O S'
_chemical_melting_point          335.15
_chemical_name_systematic
'(S,R)-1-Chloro-2-phenylethyl p-tolyl sulfoxide'
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 97.94(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.685(2)
_cell_length_b                   5.006(1)
_cell_length_c                   18.580(5)
_cell_volume                     707.941
_diffrn_ambient_temperature      213
_exptl_crystal_colour            colorless.
_exptl_crystal_density_diffrn    1.308
_exptl_crystal_description       plate
_refine_ls_R_factor_gt           7.0
_refine_ls_wR_factor_gt          7.0
_cod_original_sg_symbol_H-M      'P 21'
_cod_original_formula_sum        'C15 H15 Cl1 O1 S1'
_cod_database_code               1100177
Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules
Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul; Journal of the American Chemical Society 122 (2000) 10218–10219; doi:10.1021/ja001283y

data_1100178
_publ_section_title
;
 Highly Regio- and Stereoselective Thermal Migration of Organoboranes
 in Acyclic Molecules
;
_journal_coden_ASTM              JACSAT
_journal_issue                   41
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              10218
_journal_page_last               10219
_journal_paper_doi               10.1021/ja001283y
_journal_volume                  122
_journal_year                    2000
_chemical_formula_moiety         'C25 H24 N2 O6'
_chemical_formula_sum            'C25 H24 N2 O6'
_chemical_name_systematic
;
3-(Diphenylmethyl)pent-2-yl 3,5-dinitrobenzoate
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                65.76(1)
_cell_angle_beta                 86.43(1)
_cell_angle_gamma                81.31(1)
_cell_formula_units_Z            2
_cell_length_a                   7.842(1)
_cell_length_b                   12.127(1)
_cell_length_c                   12.973(1)
_cell_volume                     1112.044
_diffrn_ambient_temperature      223
_exptl_crystal_colour            colorless.
_exptl_crystal_density_diffrn    1.339
_refine_ls_R_factor_gt           4.44
_refine_ls_wR_factor_gt          4.44
_cod_database_code               1100178
Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules
Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul; Journal of the American Chemical Society 122 (2000) 10218–10219; doi:10.1021/ja001283y

data_1100179
_publ_section_title
;
 Highly Regio- and Stereoselective Thermal Migration of Organoboranes
 in Acyclic Molecules
;
_journal_coden_ASTM              JACSAT
_journal_issue                   41
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              10218
_journal_page_last               10219
_journal_paper_doi               10.1021/ja001283y
_journal_volume                  122
_journal_year                    2000
_chemical_formula_moiety         'C18 H22 O1'
_chemical_formula_sum            'C18 H22 O'
_chemical_name_systematic        3,4-Diphenylhexan-2-ol
_space_group_IT_number           146
_symmetry_cell_setting           rhombohedral
_symmetry_space_group_name_Hall  'R 3'
_symmetry_space_group_name_H-M   'R 3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            9
_cell_length_a                   23.056(1)
_cell_length_b                   23.056(1)
_cell_length_c                   7.325(1)
_cell_volume                     3372.145
_diffrn_ambient_temperature      223
_exptl_crystal_density_diffrn    1.127
_exptl_crystal_preparation       colorless
_refine_ls_R_factor_gt           3.05
_refine_ls_wR_factor_gt          3.05
_cod_original_sg_symbol_H-M      'R 3'
_cod_original_formula_sum        'C18 H22 O1'
_cod_database_code               1100179
Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules
Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul; Journal of the American Chemical Society 122 (2000) 10218–10219; doi:10.1021/ja001283y

data_1100180
_publ_section_title
;
 Highly Regio- and Stereoselective Thermal Migration of Organoboranes
 in Acyclic Molecules
;
_journal_coden_ASTM              JACSAT
_journal_issue                   41
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              10218
_journal_page_last               10219
_journal_paper_doi               10.1021/ja001283y
_journal_volume                  122
_journal_year                    2000
_chemical_formula_moiety         'C17 H20 O1'
_chemical_formula_sum            'C17 H20 O'
_chemical_name_systematic        3,4-Diphenylpentan-2-ol
_space_group_IT_number           146
_symmetry_cell_setting           rhombohedral
_symmetry_space_group_name_Hall  'R 3'
_symmetry_space_group_name_H-M   'R 3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            9
_cell_length_a                   22.864(1)
_cell_length_b                   22.864(1)
_cell_length_c                   7.229(1)
_cell_volume                     3272.753
_diffrn_ambient_temperature      223
_exptl_crystal_colour            colorless.
_exptl_crystal_density_diffrn    1.097
_refine_ls_R_factor_gt           4.89
_refine_ls_wR_factor_gt          4.89
_cod_original_sg_symbol_H-M      'R 3'
_cod_original_formula_sum        'C17 H20 O1'
_cod_database_code               1100180
Kristallstruktur des Isothiocyanato-Komplexes [Ph~3~PNH~2~(OEt~2~)][Sm(NCS)~4~(DME)~2~]
Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt; Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 125–127; doi:10.1002/1521-3749(200102)627:2<125::AID-ZAAC125>3.0.CO;2-O

data_1100181
_publ_section_title
;
 Kristallstruktur des Isothiocyanato-Komplexes
 [Ph~3~PNH~2~(OEt~2~)][Sm(NCS)~4~(DME)~2~]
;
_journal_coden_ASTM              ZAACAB
_journal_issue                   2
_journal_name_full
;
 Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_page_first              125
_journal_page_last               127
_journal_paper_doi
10.1002/1521-3749(200102)627:2<125::AID-ZAAC125>3.0.CO;2-O
_journal_volume                  627
_journal_year                    2001
_chemical_formula_moiety
;
C18 H17 N1 P1 1+,C12 H20 N4 O4 S4 Sm1 1-,C4 H10 O1
;
_chemical_formula_sum            'C34 H47 N5 O5 P S4 Sm'
_chemical_name_systematic
;
Amino-triphenylphosphonium tetrakis(isothiocyanato)-bis(1,2-dimethoxyethane-O,
O')-samarium(iii) diethyl ether solvate
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                96.748(10)
_cell_angle_beta                 94.827(10)
_cell_angle_gamma                91.720(11)
_cell_formula_units_Z            4
_cell_length_a                   9.1900(8)
_cell_length_b                   19.6516(18)
_cell_length_c                   24.0125(19)
_cell_volume                     4287.808
_diffrn_ambient_temperature      193
_exptl_crystal_colour            colorless.
_exptl_crystal_density_diffrn    1.418
_exptl_crystal_description       nugget
_exptl_crystal_preparation       'dimethoxyethane/diethyl ether'
_refine_ls_R_factor_gt           2.91
_refine_ls_wR_factor_gt          2.91
_cod_original_formula_sum        'C34 H47 N5 O5 P1 S4 Sm1'
_cod_database_code               1100181
Iron(II)-catalyzed intramolecular aminochlorination of alkenes
Bach, Thorsten; Schlummer, Björn; Harms, Klaus; Chemical Communications (Cambridge, United Kingdom)  (2000) 287–288; doi:10.1039/a909009f

data_1100182
_publ_section_title
;
 Iron(II)-catalyzed intramolecular aminochlorination of alkenes
;
_journal_coden_ASTM              CHCOFS
_journal_issue                   4
_journal_name_full
;
 Chemical Communications (Cambridge, United Kingdom)
;
_journal_page_first              287
_journal_page_last               288
_journal_paper_doi               10.1039/a909009f
_journal_year                    2000
_chemical_formula_moiety         'C10 H10 Cl1 N1 O2'
_chemical_formula_sum            'C10 H10 Cl N O2'
_chemical_name_systematic
;
threo-4-(Chloro(phenyl)methyl)-1,3-oxazolidin-2-one
;
_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
_cell_angle_beta                 94.175(4)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.8902(2)
_cell_length_b                   5.8375(3)
_cell_length_c                   20.5524(7)
_cell_volume                     944.112
_diffrn_ambient_temperature      213
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.489
_exptl_crystal_description       plate
_refine_ls_R_factor_gt           4.59
_refine_ls_wR_factor_gt          4.59
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C10 H10 Cl1 N1 O2'
_cod_database_code               1100182
T.Bach; H.Bergmann; K.Harms; Angew.Chem.,Int.Ed.Engl. 39 (2000) 2302–; doi:10.1002/1521-3773(20000703)39:13<2302::AID-ANIE2302>3.0.CO;2-6

data_1100183
_journal_name_full               Angew.Chem.,Int.Ed.Engl.
_journal_page_first              2302
_journal_paper_doi
10.1002/1521-3773(20000703)39:13<2302::AID-ANIE2302>3.0.CO;2-6
_journal_volume                  39
_journal_year                    2000
_chemical_formula_moiety
;
C22 H37 N1 O3,C1 H2 Cl2
;
_chemical_formula_sum            'C23 H39 Cl2 N O3'
_chemical_name_systematic
;
Menthan-7-yl 2,4,7-trimethyl-2,4-trimethylene-5-pentane lactam-7-carboxylate d
ichloromethane solvate
;
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.520(1)
_cell_length_b                   12.123(1)
_cell_length_c                   24.105(1)
_cell_volume                     2489.756
_diffrn_ambient_temperature      ?
_exptl_crystal_colour            colorless.
_exptl_crystal_density_diffrn    1.196
_exptl_crystal_description       Regular
_refine_ls_R_factor_gt           6.08
_refine_ls_wR_factor_gt          6.08
_cod_original_formula_sum        'C23 H39 Cl2 N1 O3'
_cod_database_code               1100183
T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke; Z.Anorg.Allg.Chem. 626 (2000) 1361–; doi:10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X

data_1100184
_journal_name_full               Z.Anorg.Allg.Chem.
_journal_page_first              1361
_journal_paper_doi
10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X
_journal_volume                  626
_journal_year                    2000
_chemical_formula_moiety
;
C12 H30 Eu1 I2 O6
;
_chemical_formula_sum            'C12 H30 Eu I2 O6'
_chemical_name_systematic
;
Di-iodo-tris(dimethoxyethane)-europium
;
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 93.793(6)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.4889(8)
_cell_length_b                   10.5945(8)
_cell_length_c                   12.2789(7)
_cell_volume                     1101.892
_diffrn_ambient_temperature      188
_exptl_crystal_colour            colorless.
_exptl_crystal_density_diffrn    2.038
_exptl_crystal_description       'triangular platelet'
_refine_ls_R_factor_gt           2.46
_refine_ls_wR_factor_gt          2.46
_cod_original_sg_symbol_H-M      'P 21'
_cod_original_formula_sum        'C12 H30 Eu1 I2 O6'
_cod_database_code               1100184
T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke; Z.Anorg.Allg.Chem. 626 (2000) 1361–; doi:10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X

data_1100185
_journal_name_full               Z.Anorg.Allg.Chem.
_journal_page_first              1361
_journal_paper_doi
10.1002/(SICI)1521-3749(200006)626:6<1361::AID-ZAAC1361>3.0.CO;2-X
_journal_volume                  626
_journal_year                    2000
_chemical_formula_moiety
;
C94 H85 Eu2 I1 N5 O2 P5,2(C4 H10 O2)
;
_chemical_formula_sum            'C102 H105 Eu2 I N5 O6 P5'
_chemical_name_systematic
;
bis(\m~2~-Triphenylphosphoraneiminato)-iodo-tris(triphenylphosphoraneiminato)-
dimethoxyethane-di-europium dimethoxyethane solvate
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                89.404(11)
_cell_angle_beta                 72.958(11)
_cell_angle_gamma                78.657(11)
_cell_formula_units_Z            2
_cell_length_a                   14.0550(14)
_cell_length_b                   16.5220(15)
_cell_length_c                   22.037(2)
_cell_volume                     4790.995
_diffrn_ambient_temperature      193
_exptl_crystal_colour            light-yellow.
_exptl_crystal_density_diffrn    1.444
_exptl_crystal_description       'triangular platelet'
_refine_ls_R_factor_gt           3.91
_refine_ls_wR_factor_gt          3.91
_cod_original_formula_sum        'C102 H105 Eu2 I1 N5 O6 P5'
_cod_database_code               1100185