Carbonate-Based Zeolitic Imidazolate Framework for Highly Selective CO2 Capture.
Basnayake, Sajani A.; Su, Jie; Zou, Xiadong; Balkus, Jr, Kenneth J; Inorganic chemistry 54 (2015) 1816–1821; doi:10.1021/ic5027174

data_4342323
_publ_section_title
;
 Carbonate-Based Zeolitic Imidazolate Framework for Highly Selective CO2
 Capture.
;
_journal_issue                   4
_journal_name_full               'Inorganic chemistry'
_journal_page_first              1816
_journal_page_last               1821
_journal_paper_doi               10.1021/ic5027174
_journal_volume                  54
_journal_year                    2015
_chemical_formula_moiety         C8H16ClCoEuO6
_chemical_formula_sum            'C8 H16 Cl Co Eu O6'
_chemical_formula_weight         454.56
_chemical_name_systematic        ' ?'
_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                90.00000
_cell_angle_beta                 121.9316(4)
_cell_angle_gamma                90.00000
_cell_formula_units_Z            8
_cell_length_a                   18.05076(10)
_cell_length_b                   11.58355(6)
_cell_length_c                   14.95352(7)
_cell_measurement_temperature    293
_cell_volume                     2653.53(3)
_computing_structure_refinement  FULLPROF
_diffrn_ambient_temperature      293
_diffrn_radiation_type           Synchrotron
_diffrn_radiation_wavelength     0.666332
_diffrn_reflns_theta_max         36.0
_diffrn_reflns_theta_min         3.10
_diffrn_source                   'CRISTAL  Beamline, SOLEIL'
_exptl_crystal_density_diffrn    2.276
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.002000
_pd_meas_2theta_range_max        35.99800
_pd_meas_2theta_range_min        3.10000
_pd_meas_number_of_points        16450
_pd_proc_2theta_range_inc        0.002000
_pd_proc_2theta_range_max        36.0015
_pd_proc_2theta_range_min        3.1035
_pd_proc_ls_pref_orient_corr     ' ?'
_pd_proc_ls_prof_R_factor        10.2688
_pd_proc_ls_prof_wR_expected     12.1338
_pd_proc_ls_prof_wR_factor       13.4198
_pd_proc_wavelength              0.666332
_pd_spec_mounting                ' ?'
_refine_ls_number_parameters     42
_refine_ls_number_reflns         1143
_refine_ls_number_restraints     0
_refine_ls_R_I_factor            6.0581
_cod_data_source_file            ic5027174_si_002.cif
_cod_data_source_block           EuCoCl(Gly)2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 

 Adding full bibliography for 4342323.cif.
;
_cod_original_cell_volume        2653.53(2)
_cod_original_sg_symbol_H-M      'C 2/C'
_cod_database_code               4342323
_pd_proc_ls_prof_cr_factor       19.7780
_pd_proc_ls_prof_cwr_factor      21.6220
_pd_proc_ls_prof_cwr_expected    19.5501
_pd_proc_ls_prof_chi2            1.2232
_pd_proc_ls_prof_echi2           1.1918