#------------------------------------------------------------------------------ #$Date: 2011-09-16 18:46:08 +0300 (Fri, 16 Sep 2011) $ #$Revision: 26025 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/2008834.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_2008834_Fobs loop_ _publ_author_name 'Kovalevsky, A. Yu.' _publ_section_title ; Redetermination of N-acetylanthranilic acid at 158K ; _journal_issue 8 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first IUC9900093 _journal_volume 55 _journal_year 1999 _space_group_IT_number 43 _symmetry_space_group_name_Hall 'F 2 -2d' _symmetry_space_group_name_H-M 'F d d 2' _exptl_crystal_F_000 1504.00 _[local]_cod_data_source_file qa0145sup2.hkl _[local]_cod_data_source_block acantrlc #BEGIN Tags that were not found in dictionaries: _shelx_title ' boorto in Fdd2' _shelx_refln_list_code 4 _shelx_f_calc_maximum 511.25 _shelx_f_squared_multiplier 1.000 #END Tags that were not found in dictionaries 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 -14 308.06 341.85 14.55 o 0 2 -14 152.54 185.90 16.90 o 2 2 -14 357.45 372.16 21.83 o 4 2 -14 206.43 209.85 18.66 o 2 4 -14 211.55 235.20 18.31 o 4 4 -14 238.43 247.52 19.72 o 0 6 -14 1119.89 1394.28 37.67 o 2 6 -14 21.62 20.77 15.84 o 4 6 -14 23.42 16.20 16.20 o 2 8 -14 187.38 217.59 19.01 o 4 8 -14 37.58 27.11 16.55 o 0 10 -14 1121.97 1311.54 35.91 o 2 10 -14 107.21 124.29 17.25 o 2 12 -14 890.10 1050.99 30.63 o 0 14 -14 102.58 117.25 17.96 o 1 1 -13 98.82 85.43 10.83 o 3 1 -13 100.51 103.51 15.14 o 5 1 -13 386.32 449.62 21.48 o 7 1 -13 157.52 161.78 12.69 o 1 3 -13 1150.94 1258.72 32.04 o 3 3 -13 212.12 209.49 17.60 o 5 3 -13 79.70 84.15 16.20 o 7 3 -13 100.68 76.61 11.82 o 1 5 -13 5.49 9.86 14.44 o 3 5 -13 873.64 978.46 27.82 o 5 5 -13 44.42 65.84 15.84 o 7 5 -13 100.65 86.61 17.25 o 1 7 -13 280.71 265.83 18.66 o 3 7 -13 128.67 136.61 17.25 o 5 7 -13 61.11 77.11 15.49 o 1 9 -13 39.48 32.39 14.79 o 3 9 -13 242.38 227.80 17.96 o 5 9 -13 656.90 630.59 25.00 o 1 11 -13 632.11 635.88 25.00 o 3 11 -13 329.31 331.32 20.07 o 5 11 -13 99.22 113.73 17.96 o 1 13 -13 128.98 126.05 16.90 o 3 13 -13 238.51 250.69 17.96 o 5 13 -13 620.85 642.92 24.65 o 1 15 -13 891.81 1025.64 28.87 o 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