#------------------------------------------------------------------------------ #$Date: 2011-09-16 18:46:08 +0300 (Fri, 16 Sep 2011) $ #$Revision: 26025 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/2202498.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_2202498_Fobs loop_ _publ_author_name 'Zhang, Baofeng' 'Chu, Sheng' 'Wang, Xiaoqing' 'Shen, Guangqiu' 'Wang, Ru-Ji' _publ_section_title ; An adduct of (1,10-phenanthroline)diperchloratobis(pyridine-4-carboxaldehyde oxime-\kN^1^)copper(II) and pyridine-4-carboxaldehyde oxime ; _journal_issue 9 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m824 _journal_page_last m826 _journal_volume 59 _journal_year 2003 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 104.165 _cell_angle_beta 90.050 _cell_angle_gamma 107.340 _cell_length_a 8.2981 _cell_length_b 13.5248 _cell_length_c 16.5280 _exptl_crystal_F_000 826.00 _reflns_d_resolution_high 0.8409 _[local]_cod_data_source_file ci6266Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' try1 in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 266.49 _shelx_f_squared_multiplier 1.000 #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 2 0 0 499.14 528.09 37.39 o 3 0 0 64.47 112.16 24.15 o 4 0 0 3443.57 3635.85 189.27 o 5 0 0 11.92 0.00 18.69 o 6 0 0 1580.61 1545.31 106.71 o 7 0 0 147.24 183.82 46.73 o 8 0 0 14.35 48.29 35.05 o 9 0 0 107.07 98.92 57.64 o -9 1 0 157.25 119.95 55.30 o -8 1 0 380.43 478.24 76.33 o -7 1 0 366.49 348.94 62.31 o -6 1 0 291.58 367.64 57.64 o -5 1 0 68.92 43.62 24.92 o -4 1 0 167.70 219.65 35.83 o -3 1 0 2951.82 2951.98 153.44 o -2 1 0 163.06 170.58 24.92 o -1 1 0 776.58 683.08 39.72 o 1 1 0 6735.87 7345.69 360.63 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