#------------------------------------------------------------------------------ #$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/01/38/2013893.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_2013893_Fobs loop_ _publ_author_name 'Lu, Li-Ping' 'Zhu, Miao-Li' 'Yang, Pin' _publ_section_title ; Chloro(L-glutamato-\k^2^N,O)(1,10-phenanthroline-\k^2^N,N')copper(II) monohydrate ; _journal_issue 1 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first m21 _journal_page_last m23 _journal_volume 60 _journal_year 2004 _space_group_IT_number 1 _symmetry_space_group_name_Hall 'P 1' _symmetry_space_group_name_H-M 'P 1' _cell_angle_alpha 66.730 _cell_angle_beta 72.047 _cell_angle_gamma 68.828 _cell_length_a 8.3022 _cell_length_b 10.0591 _cell_length_c 12.3928 _exptl_crystal_F_000 454.00 _reflns_d_resolution_high 0.8406 _[local]_cod_data_source_file sx1128Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' llp5 in P1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 262.21 _shelx_f_squared_multiplier 1.000 #END Tags that were not found in dictionaries loop_ _symmetry_equiv_pos_as_xyz '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 -4 -7 -14 77.06 63.33 4.96 o -3 -7 -14 86.03 92.63 6.76 o -2 -7 -14 15.77 13.75 1.58 o -3 -6 -14 32.84 36.51 2.70 o -2 -6 -14 494.03 524.67 27.04 o -1 -6 -14 34.66 34.71 3.16 o -3 -5 -14 872.82 935.76 36.06 o -2 -5 -14 99.37 84.06 7.66 o -5 -9 -13 29.33 31.55 2.70 o -4 -9 -13 222.31 237.54 17.80 o -3 -9 -13 243.84 245.43 18.48 o -5 -8 -13 273.61 326.12 20.51 o -4 -8 -13 780.83 956.04 38.99 o -3 -8 -13 34.75 27.95 2.48 o -2 -8 -13 20.20 13.30 1.35 o -1 -8 -13 6.81 4.28 1.13 o -5 -7 -13 270.78 286.23 17.80 o -4 -7 -13 6.85 4.28 0.90 o -3 -7 -13 10.70 10.82 1.35 o -2 -7 -13 120.67 110.88 8.56 o -1 -7 -13 302.76 323.19 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