#------------------------------------------------------------------------------ #$Date: 2016-04-03 06:29:21 +0300 (Sun, 03 Apr 2016) $ #$Revision: 181243 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/23/21/2232115.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_2232115_Fobs loop_ _publ_author_name 'Deng, Yi-Fang' 'Chen, Man-Sheng' 'Zhang, Chun-Hua' 'Kuang, Dai-Zhi' _publ_section_title ; Poly[[tetraaquatetrakis[\m~3~-5-(pyridine-4-carboxamido)isophthalato]cobalt(II)digadolinium(III)] tetrahydrate] ; _journal_coeditor_code XU5327 _journal_issue 10 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m1431 _journal_page_last m1432 _journal_volume 67 _journal_year 2011 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 79.123 _cell_angle_beta 78.844 _cell_angle_gamma 86.317 _cell_length_a 10.1457 _cell_length_b 10.8728 _cell_length_c 13.7552 _exptl_crystal_F_000 819.00 _reflns_d_resolution_high 0.8401 _cod_data_source_file xu5327Isup2.hkl _cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' 1 P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 350.84 _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 80.47 55.66 10.94 o 2 0 0 5805.46 6139.03 108.17 o 3 0 0 123086.61 118337.36 916.64 o 4 0 0 230.52 276.69 30.02 o 5 0 0 8192.41 8450.36 143.05 o 6 0 0 20046.79 21041.15 252.67 o 7 0 0 118.56 136.85 55.42 o 8 0 0 3825.57 3795.15 214.15 o 9 0 0 5782.48 5446.36 275.41 o 10 0 0 1437.04 1279.55 150.95 o 11 0 0 802.21 796.56 142.44 o -11 1 0 2680.98 2779.09 234.57 o -10 1 0 47.45 72.68 62.96 o -9 1 0 268.08 288.05 87.51 o -8 1 0 2225.49 1988.60 162.62 o -7 1 0 1507.05 1519.47 133.21 o -6 1 0 685.36 608.49 50.32 o -5 1 0 3220.05 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