#------------------------------------------------------------------------------ #$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/21/96/2219673.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_2219673_Fobs loop_ _publ_author_name 'Aghabozorg, Hossein' 'Ilaie, Neda' 'Heidari, Mohammad' 'Manteghi, Faranak' 'Pasdar, Hoda' _publ_section_title ; catena-Poly[[[aquacadmium(II)]bis(\m-4-hydroxypyridine-2,6-dicarboxylato)[aquacadmium(II)]di-\m-aqua] tetrahydrate] ; _journal_coeditor_code OM2258 _journal_issue 10 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m1351 _journal_page_last m1352 _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 87.910 _cell_angle_beta 74.239 _cell_angle_gamma 80.478 _cell_length_a 9.4499 _cell_length_b 10.8633 _cell_length_c 11.2086 _exptl_crystal_F_000 720.00 _reflns_d_resolution_high 0.7097 _[local]_cod_data_source_file om2258Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' CdMH in P-1' _shelx_refln_list_code 4 _shelx_F_calc_maximum 431.20 _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 33747.60 34924.33 450.85 o 2 0 0 2022.21 1854.76 44.60 o 3 0 0 962.43 825.85 51.42 o 4 0 0 1732.64 1754.34 69.26 o 5 0 0 1154.59 1281.60 72.41 o 6 0 0 9248.46 9221.78 267.13 o 7 0 0 3145.57 3068.65 203.12 o 8 0 0 1938.05 2168.41 111.06 o 9 0 0 0.04 18.34 150.88 o 10 0 0 817.65 692.85 150.46 o 11 0 0 1353.82 1341.63 172.95 o 12 0 0 281.11 331.88 151.93 o -12 1 0 183.00 208.18 147.73 o -11 1 0 1152.51 1107.85 168.72 o -10 1 0 304.52 614.42 165.72 o -9 1 0 153.26 13.03 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