From Hydrated Ni3(OH)2(C8H4O4)2(H2O)4 to Anhydrous Ni2(OH)2(C8H4O4): Impact of Structural Transformations on Magnetic Properties.
Mesbah, Adel; Rabu, Pierre; Sibille, Romain; Lebègue, Sébastien; Mazet, Thomas; Malaman, Bernard; François, Michel; Inorganic chemistry 53 (2014) 872–881; doi:10.1021/ic402106v

data_4337140
_publ_section_title
;
 From Hydrated Ni3(OH)2(C8H4O4)2(H2O)4 to Anhydrous Ni2(OH)2(C8H4O4):
 Impact of Structural Transformations on Magnetic Properties.
;
_journal_issue                   2
_journal_name_full               'Inorganic chemistry'
_journal_page_first              872
_journal_page_last               881
_journal_paper_doi               10.1021/ic402106v
_journal_volume                  53
_journal_year                    2014
_chemical_formula_analytical     'C16 H14 Ni3 O12'
_chemical_formula_moiety         'C16 H14 Ni3 O12'
_chemical_formula_sum            'C16 H14 Ni3 O12'
_chemical_formula_weight         574.34
_chemical_name_systematic        ' ?'
_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                81.519(8)
_cell_angle_beta                 82.589(8)
_cell_angle_gamma                85.660(6)
_cell_formula_units_Z            1
_cell_length_a                   6.2784(5)
_cell_length_b                   6.6630(3)
_cell_length_c                   10.1465(8)
_cell_measurement_temperature    298
_cell_volume                     415.61(5)
_computing_structure_refinement  FULLPROF
_diffrn_ambient_temperature      298
_diffrn_radiation_type           'Cu K\a'
_diffrn_radiation_wavelength     1.54180
_diffrn_source                   'rotating-anode X-ray tube'
_exptl_crystal_density_diffrn    2.295
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.016716
_pd_meas_2theta_range_max        60.01485
_pd_meas_2theta_range_min        5.01807
_pd_meas_number_of_points        3292
_pd_proc_2theta_range_inc        0.016716
_pd_proc_2theta_range_max        60.0562
_pd_proc_2theta_range_min        5.0594
_pd_proc_ls_pref_orient_corr     ' ?'
_pd_proc_ls_prof_R_factor        5.0548
_pd_proc_ls_prof_wR_expected     0.8824
_pd_proc_ls_prof_wR_factor       7.3948
_pd_proc_wavelength              1.540560
_pd_spec_mounting                ' ?'
_refine_ls_number_parameters     27
_refine_ls_number_reflns         477
_refine_ls_number_restraints     12
_refine_ls_R_I_factor            12.2363
_cod_data_source_file            ic402106v_si_003.cif
_cod_data_source_block           ni3-oh2-tp2-2h2o
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/automatic-downloads/current/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 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_cell_volume        415.62(5)
_cod_database_code               4337140
_pd_proc_ls_prof_cr_factor       23.2153
_pd_proc_ls_prof_cwr_factor      24.0558
_pd_proc_ls_prof_cwr_expected    2.8706
_pd_proc_ls_prof_chi2            70.2265
_pd_proc_ls_prof_echi2           71.3589