#------------------------------------------------------------------------------ #$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/21/74/2217411.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_2217411_Fobs loop_ _publ_author_name 'Aghabozorg, Hossein' 'Nemati, Andya' 'Derikvand, Zohreh' 'Ghadermazi, Mohammad' _publ_section_title ; Poly[piperazinediium [[aquabismuthate(III)]-di-\m-pyridine-2,6-dicarboxylato-bismuthate(III)-di-\m-pyridine-2,6-dicarboxylato] monohydrate] ; _journal_coeditor_code BI2264 _journal_issue 2 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m374 _journal_volume 64 _journal_year 2008 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 96.094 _cell_angle_beta 93.169 _cell_angle_gamma 113.848 _cell_length_a 10.8111 _cell_length_b 12.1660 _cell_length_c 14.0402 _exptl_crystal_F_000 1144.00 _reflns_d_resolution_high 0.7570 _[local]_cod_data_source_file bi2264Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' bi_a1b8 in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 494.97 _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 1 0 0 11478.05 12147.71 254.66 o 2 0 0 63166.79 66899.34 858.11 o 3 0 0 30491.54 31203.75 733.09 o 5 0 0 54202.35 55173.12 746.73 o 6 0 0 11147.31 10837.90 195.13 o 7 0 0 3265.26 3344.13 124.58 o 8 0 0 22746.13 23094.88 528.32 o 9 0 0 8050.06 8351.16 207.61 o 10 0 0 9323.95 9523.68 312.10 o 11 0 0 12577.79 13676.08 440.75 o 12 0 0 271.71 297.23 97.89 o -13 1 0 560.36 517.46 115.28 o -12 1 0 9263.46 9691.52 330.95 o -11 1 0 7285.14 7914.54 261.89 o -10 1 0 17.85 14.05 52.47 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