#------------------------------------------------------------------------------ #$Date: 2011-09-16 18:46:08 +0300 (Fri, 16 Sep 2011) $ #$Revision: 26025 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/2015632.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_2015632_Fobs loop_ _publ_author_name '\,Sahin, Onur' 'B\"uy\"ukg\"ung\"or, Orhan' 'K\"ose, Dursun Ali' 'Z\"umreoglu-Karan, Birg\"ul' 'Necefoglu, Hacali' _publ_section_title ; catena-Poly[[[triaquacobalt(II)]-\m-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylato(2--)] 1.72-hydrate] ; _journal_coeditor_code BG3013 _journal_issue 11 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first m513 _journal_page_last m515 _journal_volume 62 _journal_year 2006 _space_group_IT_number 169 _symmetry_space_group_name_Hall 'P 61' _symmetry_space_group_name_H-M 'P 61' _cell_angle_alpha 90.000 _cell_angle_beta 90.000 _cell_angle_gamma 120.000 _cell_length_a 13.4646 _cell_length_b 13.4646 _cell_length_c 9.8777 _exptl_crystal_F_000 890.00 _reflns_d_resolution_high 0.8108 _[local]_cod_data_source_file bg3013Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' TEST STRUCTURE D:\DATA\ORHBIRGUL2_DENE\ORHBIRGUL2' _shelx_refln_list_code 4 _shelx_f_calc_maximum 153.65 _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+1/2' '-y, x-y, z+1/3' 'y, -x+y, z+5/6' '-x+y, -x, z+2/3' 'x-y, x, z+1/6' 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 0 0 -12 633.37 479.15 67.38 o 0 1 -12 68.96 92.05 26.84 o -1 2 -12 91.44 75.87 29.58 o 0 2 -12 43.56 40.46 31.46 o 0 1 -11 408.59 366.86 25.44 o -1 2 -11 75.28 55.26 25.21 o 0 2 -11 1151.58 1133.37 40.12 o -2 3 -11 415.61 350.44 27.81 o -1 3 -11 25.34 23.60 24.61 o 0 3 -11 774.24 727.03 30.76 o -3 4 -11 863.45 889.73 33.24 o -2 4 -11 89.42 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