#------------------------------------------------------------------------------ #$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/21/72/2217233.hkl $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2217233_Fobs loop_ _publ_author_name 'Aghabozorg, Hossein' 'Motyeian, Elham' 'Attar Gharamaleki, Jafar' 'Soleimannejad, Janet' 'Ghadermazi, Mohammad' 'Spey Sharon, Elizabeth' _publ_section_title ; Bis(guanidinium) bis(4-hydroxypyridine-2,6-dicarboxylato-\k^3^O^2^,N,O^6^)nickelate(II) dihydrate ; _journal_coeditor_code OM2189 _journal_issue 1 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m144 _journal_page_last m145 _journal_volume 64 _journal_year 2008 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 101.415 _cell_angle_beta 103.099 _cell_angle_gamma 91.938 _cell_length_a 8.92530 _cell_length_b 9.9060 _cell_length_c 13.2186 _exptl_crystal_F_000 596.00 _reflns_d_resolution_high 0.7709 _[local]_cod_data_source_file om2189Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' jan02 P-1 R = 0.03 ' _shelx_refln_list_code 4 _shelx_f_calc_maximum 201.52 _shelx_f_squared_multiplier 0.010 #END Tags that were not found in dictionaries loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,-z loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_calc _refln_F_squared_meas _refln_F_squared_sigma _refln_observed_status _refln_sint/lambda 1 0 0 130371.30 130371.30 3610.70 o 0.05771 2 0 0 166.56 166.56 129.06 o 0.11543 3 0 0 69133.39 69133.39 2629.32 o 0.17314 4 0 0 71663.51 71663.51 2677.00 o 0.23085 5 0 0 143701.77 143701.77 3790.80 o 0.28857 6 0 0 466613.34 466613.34 6830.91 o 0.34628 7 0 0 668.66 668.66 258.58 o 0.40399 8 0 0 27299.88 27299.88 1652.27 o 0.46171 9 0 0 28026.49 28026.49 1674.11 o 0.51942 10 0 0 931.98 931.98 305.28 o 0.57713 11 0 0 7805.45 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