#------------------------------------------------------------------------------ #$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/10/40/2104011.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_2104011_Fobs loop_ _publ_author_name 'Cowan, John A.' 'Howard, Judith A. K.' 'McIntyre, Garry J.' 'Lo, Samuel M.-F.' 'Williams, Ian D.' _publ_section_title ; Variable-temperature neutron diffraction studies of the short, strong N···O hydrogen bonds in the 1:2 co-crystal of benzene-1,2,4,5-tetracarboxylic acid and 4,4'-bipyridyl ; _journal_issue 6 _journal_name_full 'Acta Crystallographica Section B' _journal_page_first 794 _journal_page_last 801 _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 64.140 _cell_angle_beta 71.682 _cell_angle_gamma 75.516 _cell_length_a 7.5011 _cell_length_b 9.7868 _cell_length_c 10.2303 _exptl_crystal_F_000 200.99 _reflns_d_resolution_high 0.7951 _[local]_cod_data_source_file bs5001hex296sup3.hkl _[local]_cod_data_source_block hex296 #BEGIN Tags that were not found in dictionaries: _shelx_title ' hex30 in P-1' _shelx_refln_list_code 3 _shelx_F_calc_maximum 170.90 #END Tags that were not found in dictionaries loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, -z' 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